| Weight | 207.233 g/mol |
|---|---|
| Formula | C10H13N3O2 |
| Hydrogen Acceptors | 4 |
| Hydrogen Donors | 0 |
| Aromatic Rings | 1 |
| Rotatable Bonds | 6 |
NNK (carcinogen) (64091-50-5, 64091-91-4)
"What do you need help with?"
LabBot
-
Predict GHS Hazards for Any Chemical in silico.
Including Acute Oral Tox, Skin Sensitization, Eye Irritation, Aquatic Tox, & more. -
SMILESCN(CCCC(=O)C1=CN=CC=C1)N=O
-
InChIKeyFLAQQSHRLBFIEZ-UHFFFAOYSA-N
- Pubchem - NNK (carcinogen)
- Wikipedia - 4-(N-nitrosomethylamino)-1-(3-pyridyl)-1-butanone
Nicotine-derived nitrosamine ketone (NNK), also known as 4-(methylnitrosamino)-1-(3-pyridyl)-1-butanone, is one of the key tobacco-specific nitrosamines which play an important role in carcinogenesis.
Suppliers
Safety
Alternate Names
Estimated Properties
| Boiling Point | 278.59 C | EPA T.E.S.T. |
|---|---|---|
| Density | 1.21 g/cm3 | EPA T.E.S.T. |
| Flash Point | 162.94 C | EPA T.E.S.T. |
| Water Solubility | 3737.39 mg/L | EPA T.E.S.T. |
External Links
Synthesis
Methylboronic acid
+
Reactant
(Chan-Lam coupling reaction)
Pyridine
+
Reactant
(Friedel-Crafts acylation)
Reactant
+
3-CHLOROPYRIDINE
(Grignard carbonyl)
Similar Compounds
Amylcinnamaldehyde
(1331-92-6, 78605-96-6, 122-40-7)
1 alternate name
2 safety hazards
3 suppliers
2-Benzylideneheptanal
(1331-92-6, 101365-33-7, 122-40-7)
1 alternate name
2 safety hazards
3 suppliers
122-40-7
(1331-92-6, 122-40-7)
1 alternate name
2 safety hazards
3 suppliers
Nikethamide
(59-26-7)
1 alternate name
3 suppliers
Hexyl cinnamic aldehyde
(101-86-0, 165184-98-5)
1 alternate name
3 suppliers
N,N-Diethyl-3-methylbenzamide
(111-40-0, 134-62-3)
1 alternate name
4 safety hazards
3 suppliers
Butyl 4-hydroxybenzoate
(94-26-8)
1 alternate name
3 suppliers
Propyl 4-hydroxybenzoate
(94-13-3)
1 alternate name
3 suppliers
4-Ipomeanol
(36878-93-0, 55659-41-1, 32954-58-8)
1 alternate name
3 suppliers
BUTYL ANTHRANILATE
(7756-96-9)
1 alternate name
3 suppliers
ISOBUTYL ANTHRANILATE
(7779-77-3)
1 alternate name
3 suppliers
Propyl 4-aminobenzoate
(94-12-2)
1 alternate name
3 suppliers
ALLYL ANTHRANILATE
(7493-63-2)
1 alternate name
3 suppliers
Isoamyl salicylate
(87-20-7)
1 alternate name
3 suppliers
Butyl salicylate
(1322-01-6, 2052-14-4)
1 alternate name
3 suppliers
MONURON
(150-68-5)
1 alternate name
5 safety hazards
3 suppliers
Ethylparaben
(120-47-8, 9001-05-2)
1 alternate name
3 suppliers
4'-Aminopropiophenone
(70-69-9)
1 alternate name
3 suppliers
N,N-Dimethyl-4-nitrosoaniline
(62-75-9, 138-89-6)
1 alternate name
2 safety hazards
3 suppliers
Ethyl 2-aminobenzoate
(87-25-2)
1 alternate name
3 suppliers
1,1-Dimethyl-3-phenylurea
(101-42-8)
1 alternate name
3 suppliers
FENURON
(101-42-8)
1 alternate name
3 suppliers
BUTYL BENZOATE
(136-60-7)
1 alternate name
3 suppliers
Hexyl benzoate
(6789-88-4)
1 alternate name
3 suppliers
Ethyl salicylate
(118-61-6, 1321-50-2)
1 alternate name
3 suppliers
METHYL 4-FORMYLBENZOATE
(1571-08-0)
1 alternate name
3 suppliers
N-Methylnicotinamide
(114-33-0)
1 alternate name
3 suppliers
N,N-Diethyl-4-nitrosoaniline
(120-22-9)
1 alternate name
3 suppliers
MONOBUTYL PHTHALATE
(131-70-4, 34-74-2)
1 alternate name
3 suppliers
chlorpropham
(101-21-3)
1 alternate name
2 safety hazards
3 suppliers
Methyl 4-hydroxybenzoate
(99-76-3)
1 alternate name
1 safety hazard
3 suppliers
Benthiocarb
(28249-77-6)
1 alternate name
3 safety hazards
3 suppliers
Propham
(122-42-9)
1 alternate name
3 suppliers
rac Cotinine
(15569-85-4, 486-56-6)
1 alternate name
3 suppliers
1-Methyl-5-(3-pyridinyl)-2-pyrrolidinone
(15569-85-4, 486-56-6)
1 alternate name
3 suppliers
cotinine
(486-56-6)
1 alternate name
3 suppliers
METHYL ANTHRANILATE
(134-20-3)
1 alternate name
3 suppliers
N-Nitroso-N-methylaniline
(614-00-6)
1 alternate name
3 suppliers
Propiophenone
(93-55-0)
1 alternate name
2 safety hazards
3 suppliers
4'-Aminoacetophenone
(99-92-3)
1 alternate name
3 suppliers
procainamide hydrochloride
(614-39-1)
1 alternate name
3 suppliers
PROCAINE HYDROCHLORIDE
(51-05-8)
1 alternate name
3 suppliers
2'-Aminoacetophenone
(27941-88-4, 551-93-9)
1 alternate name
3 suppliers
alpha-Methyl cinnamaldehyde
(101-39-3, 66051-14-7)
1 alternate name
3 suppliers
4'-Hydroxyacetophenone
(99-93-4)
1 alternate name
3 suppliers
ALPHA-METHYLCINNAMALDEHYDE
(101-39-3, 15174-47-7)
1 alternate name
3 suppliers
Thbp
(1421-63-2)
1 alternate name
3 suppliers
ETHYL BENZOATE
(70750-03-7, 93-89-0, 70750-02-6, 70750-04-8)
1 alternate name
3 suppliers
1-PHENYL-1,2-PROPANEDIONE
(579-07-7)
1 alternate name
3 suppliers
Hordenine
(62493-39-4, 3595-05-9, 539-15-1)
1 alternate name
3 suppliers
N-METHYLBENZAMIDE
(613-93-4)
1 alternate name
3 suppliers
Isopropyl phenylacetate
(4861-85-2)
1 alternate name
3 suppliers
3-ACETYLPYRIDINE
(350-03-8)
1 alternate name
3 suppliers
2'-Hydroxyacetophenone
(118-93-4)
1 alternate name
3 suppliers
Monoethyl phthalate
(2306-33-4)
1 alternate name
3 suppliers
ALPHA-METHYLCINNAMALDEHYDE
(101-39-3)
1 alternate name
3 suppliers
CUMENE HYDROPEROXIDE
(80-15-9)
1 alternate name
9 safety hazards
3 suppliers
4-tert-Amylphenol
(80-46-6)
1 alternate name
3 suppliers
METHYL BENZOATE
(93-58-3)
1 alternate name
1 safety hazard
3 suppliers
Lidocaine hydrochloride
(73-78-9)
1 alternate name
3 suppliers
99-98-9
(99-98-9)
1 alternate name
2 safety hazards
3 suppliers
1-Phenoxy-2-propanol
(770-35-4)
1 alternate name
1 safety hazard
3 suppliers
MONOLINURON
(1746-81-2)
1 alternate name
3 safety hazards
3 suppliers
2-sec-Butylphenol
(53466-96-9, 89-72-5)
1 alternate name
3 safety hazards
3 suppliers
METOBROMURON
(3060-89-7)
1 alternate name
3 suppliers
4'-Methoxyacetophenone
(100-06-1)
1 alternate name
3 suppliers
2-TERT-BUTYLPHENOL
(88-18-6, 27178-34-3)
1 alternate name
5 safety hazards
3 suppliers
ACETOACETANILIDE
(102-01-2, 86349-51-1)
1 alternate name
3 suppliers
4'-Chloroacetophenone
(99-91-2)
1 alternate name
1 safety hazard
3 suppliers
CHLORBUFAM
(1967-16-4)
1 alternate name
3 suppliers
2-Phenyl-2-propanol
(617-94-7)
1 alternate name
3 suppliers
4-nonylphenol
(104-40-5, 68081-86-7, 25154-52-3)
1 alternate name
3 suppliers
4-tert-Butylphenol
(98-54-4, 30813-81-1)
1 alternate name
4 safety hazards
3 suppliers
N-Phenylurethane
(101-99-5)
1 alternate name
3 suppliers
93-05-0
(93-05-0)
1 alternate name
1 safety hazard
3 suppliers
4-OCTYLPHENOL
(71902-25-5, 1806-26-4)
1 alternate name
2 safety hazards
3 suppliers
Prosulfocarb
(52888-80-9)
1 alternate name
3 safety hazards
3 suppliers
NNK (carcinogen)
CAS Directory
