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136823-41-1 | 2-Propenoic acid, 3-cyclopentyl-, methyl ester, (2E)-
CAS No: 136823-41-1 Catalog No: AG0012EQ MDL No:MFCD24134929
Product Description
Catalog Number:
AG0012EQ
Chemical Name:
2-Propenoic acid, 3-cyclopentyl-, methyl ester, (2E)-
CAS Number:
136823-41-1
Molecular Formula:
C9H14O2
Molecular Weight:
154.2063
MDL Number:
MFCD24134929
IUPAC Name:
methyl (E)-3-cyclopentylprop-2-enoate
InChI:
InChI=1S/C9H14O2/c1-11-9(10)7-6-8-4-2-3-5-8/h6-8H,2-5H2,1H3/b7-6+
InChI Key:
DKBNVGOWHNOALZ-VOTSOKGWSA-N
SMILES:
COC(=O)/C=C/C1CCCC1
Properties
Complexity:
155
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
154.099g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
154.209g/mol
Monoisotopic Mass:
154.099g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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