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129872-08-8 | 2-Cyclopentene-1-carboxylic acid, 2-methyl-
CAS No: 129872-08-8 Catalog No: AG000TR6 MDL No:
Product Description
Catalog Number:
AG000TR6
Chemical Name:
2-Cyclopentene-1-carboxylic acid, 2-methyl-
CAS Number:
129872-08-8
Molecular Formula:
C7H10O2
Molecular Weight:
126.1531
IUPAC Name:
2-methylcyclopent-2-ene-1-carboxylic acid
InChI:
InChI=1S/C7H10O2/c1-5-3-2-4-6(5)7(8)9/h3,6H,2,4H2,1H3,(H,8,9)
InChI Key:
DFAXEGZDXSEPEX-UHFFFAOYSA-N
SMILES:
CC1=CCCC1C(=O)O
Properties
Complexity:
158
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
126.068g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
126.155g/mol
Monoisotopic Mass:
126.068g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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