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15026-82-1 | Cyclopentanecarboxylic acid, 1-[(4-chlorobenzoyl)amino]-
CAS No: 15026-82-1 Catalog No: AG001MG5 MDL No:MFCD07021291
Product Description
Catalog Number:
AG001MG5
Chemical Name:
Cyclopentanecarboxylic acid, 1-[(4-chlorobenzoyl)amino]-
CAS Number:
15026-82-1
Molecular Formula:
C13H14ClNO3
Molecular Weight:
267.7082
MDL Number:
MFCD07021291
IUPAC Name:
1-[(4-chlorobenzoyl)amino]cyclopentane-1-carboxylic acid
InChI:
InChI=1S/C13H14ClNO3/c14-10-5-3-9(4-6-10)11(16)15-13(12(17)18)7-1-2-8-13/h3-6H,1-2,7-8H2,(H,15,16)(H,17,18)
InChI Key:
NMVQYHKJSJCHQU-UHFFFAOYSA-N
SMILES:
O=C(c1ccc(cc1)Cl)NC1(CCCC1)C(=O)O
Properties
Complexity:
331
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.066g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
267.709g/mol
Monoisotopic Mass:
267.066g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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