200,000+ products from a single source!
sales@angenechem.com
1311254-63-3 | Hexanoic acid, 5-methyl-3-[[(phenylmethoxy)carbonyl]amino]-
CAS No: 1311254-63-3 Catalog No: AG000VKS MDL No:
Product Description
Catalog Number:
AG000VKS
Chemical Name:
Hexanoic acid, 5-methyl-3-[[(phenylmethoxy)carbonyl]amino]-
CAS Number:
1311254-63-3
Molecular Formula:
C15H21NO4
Molecular Weight:
279.3315
IUPAC Name:
5-methyl-3-(phenylmethoxycarbonylamino)hexanoic acid
InChI:
InChI=1S/C15H21NO4/c1-11(2)8-13(9-14(17)18)16-15(19)20-10-12-6-4-3-5-7-12/h3-7,11,13H,8-10H2,1-2H3,(H,16,19)(H,17,18)
InChI Key:
NXDHEHGNNDPBNL-UHFFFAOYSA-N
SMILES:
CC(CC(NC(=O)OCc1ccccc1)CC(=O)O)C
Properties
Complexity:
311
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
279.147g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
279.336g/mol
Monoisotopic Mass:
279.147g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.