200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 116437-36-6
116437-36-6 | Carbamic acid, (5-oxononyl)-, phenylmethyl ester (9CI)
CAS No: 116437-36-6 Catalog No: AG000CHP MDL No:
Product Description
Catalog Number:
AG000CHP
Chemical Name:
Carbamic acid, (5-oxononyl)-, phenylmethyl ester (9CI)
CAS Number:
116437-36-6
Molecular Formula:
C17H25NO3
Molecular Weight:
291.3853
IUPAC Name:
benzyl N-(5-oxononyl)carbamate
InChI:
InChI=1S/C17H25NO3/c1-2-3-11-16(19)12-7-8-13-18-17(20)21-14-15-9-5-4-6-10-15/h4-6,9-10H,2-3,7-8,11-14H2,1H3,(H,18,20)
InChI Key:
MCEICHLPTQZBEH-UHFFFAOYSA-N
SMILES:
CCCCC(=O)CCCCNC(=O)OCc1ccccc1
Properties
Complexity:
298
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
291.183g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
291.391g/mol
Monoisotopic Mass:
291.183g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
55.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.