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19042-33-2 | Cyclopentanecarboxylic acid, 3-(aminocarbonyl)-, cis- (9CI)
CAS No: 19042-33-2 Catalog No: AG002EJG MDL No:MFCD30583978
Product Description
Catalog Number:
AG002EJG
Chemical Name:
Cyclopentanecarboxylic acid, 3-(aminocarbonyl)-, cis- (9CI)
CAS Number:
19042-33-2
Molecular Formula:
C7H11NO3
Molecular Weight:
157.1671
MDL Number:
MFCD30583978
IUPAC Name:
3-carbamoylcyclopentane-1-carboxylic acid
InChI:
InChI=1S/C7H11NO3/c8-6(9)4-1-2-5(3-4)7(10)11/h4-5H,1-3H2,(H2,8,9)(H,10,11)
InChI Key:
JLLHYSHCVKOWSD-UHFFFAOYSA-N
SMILES:
NC(=O)[C@@H]1CC[C@@H](C1)C(=O)O
NSC Number:
409674
Properties
Complexity:
190
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
157.074g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
157.169g/mol
Monoisotopic Mass:
157.074g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
80.4A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.5
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