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113686-66-1 | 2-Propenoic acid, 2-methyl-, 1-cyclopropylethyl ester
CAS No: 113686-66-1 Catalog No: AG0009BQ MDL No:
Product Description
Catalog Number:
AG0009BQ
Chemical Name:
2-Propenoic acid, 2-methyl-, 1-cyclopropylethyl ester
CAS Number:
113686-66-1
Molecular Formula:
C9H14O2
Molecular Weight:
154.2063
IUPAC Name:
1-cyclopropylethyl 2-methylprop-2-enoate
InChI:
InChI=1S/C9H14O2/c1-6(2)9(10)11-7(3)8-4-5-8/h7-8H,1,4-5H2,2-3H3
InChI Key:
KBMUUVHLNRRNFY-UHFFFAOYSA-N
SMILES:
CC(C1CC1)OC(=O)C(=C)C
Properties
Complexity:
180
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
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:
4
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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