200,000+ products from a single source!
sales@angenechem.com
124521-15-9 | 3-Pyridinemethanamine, N-nitroso-N-pentyl-
CAS No: 124521-15-9 Catalog No: AG000M5T MDL No:
Product Description
Catalog Number:
AG000M5T
Chemical Name:
3-Pyridinemethanamine, N-nitroso-N-pentyl-
CAS Number:
124521-15-9
Molecular Formula:
C11H17N3O
Molecular Weight:
207.2722
IUPAC Name:
N-pentyl-N-(pyridin-3-ylmethyl)nitrous amide
InChI:
InChI=1S/C11H17N3O/c1-2-3-4-8-14(13-15)10-11-6-5-7-12-9-11/h5-7,9H,2-4,8,10H2,1H3
InChI Key:
UALWODOTRBXTPK-UHFFFAOYSA-N
SMILES:
CCCCCN(Cc1cccnc1)N=O
Properties
Complexity:
175
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.137g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
207.277g/mol
Monoisotopic Mass:
207.137g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
45.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
Literature
| Title | Journal |
|---|---|
| Determination of four tobacco-specific nitrosamines in mainstream cigarette smoke by gas chromatography/ion trap mass spectrometry. | Rapid communications in mass spectrometry : RCM 20070101 |
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.