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2348-89-2 | 2-Cyclopentene-1-carboxylic acid
CAS No: 2348-89-2 Catalog No: AG002NDJ MDL No:MFCD12406852
Product Description
Catalog Number:
AG002NDJ
Chemical Name:
2-Cyclopentene-1-carboxylic acid
CAS Number:
2348-89-2
Molecular Formula:
C6H8O2
Molecular Weight:
112.1265
MDL Number:
MFCD12406852
IUPAC Name:
cyclopent-2-ene-1-carboxylic acid
InChI:
InChI=1S/C6H8O2/c7-6(8)5-3-1-2-4-5/h1,3,5H,2,4H2,(H,7,8)
InChI Key:
MOMBAXHNIPLMSI-UHFFFAOYSA-N
SMILES:
OC(=O)C1CCC=C1
Properties
Complexity:
127
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
112.052g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
112.128g/mol
Monoisotopic Mass:
112.052g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1
Literature
| Title | Journal |
|---|---|
| Asymmetric synthesis of a chiral building block for cyclopentanoids: a novel enantioselective synthesis of preclavulone A. | The Journal of organic chemistry 20061027 |
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