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138744-95-3 | 2-Propenoic acid, 2-methyl-, 2-phenylethenyl ester
CAS No: 138744-95-3 Catalog No: AG0019FU MDL No:
Product Description
Catalog Number:
AG0019FU
Chemical Name:
2-Propenoic acid, 2-methyl-, 2-phenylethenyl ester
CAS Number:
138744-95-3
Molecular Formula:
C12H12O2
Molecular Weight:
188.2225
IUPAC Name:
2-phenylethenyl 2-methylprop-2-enoate
InChI:
InChI=1S/C12H12O2/c1-10(2)12(13)14-9-8-11-6-4-3-5-7-11/h3-9H,1H2,2H3
InChI Key:
CWZWBNXFJNGGRL-UHFFFAOYSA-N
SMILES:
CC(=C)C(=O)OC=Cc1ccccc1
Properties
Complexity:
235
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.084g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
188.226g/mol
Monoisotopic Mass:
188.084g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3.1
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