4-(Acetoxymethyl)nitrosamino]-1-(3-pyridyl)-1-butanone

Modify Date: 2024-01-17 16:00:22

4-(Acetoxymethyl)nitrosamino]-1-(3-pyridyl)-1-butanone Structure
4-(Acetoxymethyl)nitrosamino]-1-(3-pyridyl)-1-butanone structure
 Common Name 4-(Acetoxymethyl)nitrosamino]-1-(3-pyridyl)-1-butanone
CAS Number 127686-49-1 Molecular Weight 265.26500
Density 1.23g/cm3 Boiling Point 476.2ºC at 760 mmHg
Molecular Formula C12H15N3O4 Melting Point 60-62ºC
MSDS N/A Flash Point 241.8ºC

 Names

Name [nitroso-(4-oxo-4-pyridin-3-ylbutyl)amino]methyl acetate
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.23g/cm3
Boiling Point 476.2ºC at 760 mmHg
Melting Point 60-62ºC
Molecular Formula C12H15N3O4
Molecular Weight 265.26500
Flash Point 241.8ºC
Exact Mass 265.10600
PSA 88.93000
LogP 1.54850
Vapour Pressure 3.12E-09mmHg at 25°C
Index of Refraction 1.556

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
EL6557000
CHEMICAL NAME :
1-Butanone, 4-(((acetyloxy)methyl)nitrosoamino)-1-(3-pyridinyl)-
CAS REGISTRY NUMBER :
127686-49-1
LAST UPDATED :
199410
DATA ITEMS CITED :
5
MOLECULAR FORMULA :
C12-H15-N3-O4
MOLECULAR WEIGHT :
265.30

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

MUTATION DATA

TYPE OF TEST :
Mutation in mammalian somatic cells
TEST SYSTEM :
Rodent - hamster Lung
DOSE/DURATION :
10 umol/L
REFERENCE :
MUREAV Mutation Research. (Elsevier Science Pub. B.V., POB 211, 1000 AE Amsterdam, Netherlands) V.1- 1964- Volume(issue)/page/year: 279,91,1992

 Synonyms

Acetoxymethyl-NNK
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Chemsrc provides CAS#:127686-49-1 MSDS, density, melting point, boiling point, structure, etc. Its name is 4-(Acetoxymethyl)nitrosamino]-1-(3-pyridyl)-1-butanone>> amp version: 4-(Acetoxymethyl)nitrosamino]-1-(3-pyridyl)-1-butanone

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