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890097-83-3 | 3-(3-ACETOXYPHENYL)-2-METHYL-1-PROPENE
CAS No: 890097-83-3 Catalog No: AG0044OW MDL No:MFCD07698669
Product Description
Catalog Number:
AG0044OW
Chemical Name:
3-(3-ACETOXYPHENYL)-2-METHYL-1-PROPENE
CAS Number:
890097-83-3
Molecular Formula:
C12H14O2
Molecular Weight:
190.2384
MDL Number:
MFCD07698669
IUPAC Name:
[3-(2-methylprop-2-enyl)phenyl] acetate
InChI:
InChI=1S/C12H14O2/c1-9(2)7-11-5-4-6-12(8-11)14-10(3)13/h4-6,8H,1,7H2,2-3H3
InChI Key:
GFZBEOHAVIRFEH-UHFFFAOYSA-N
SMILES:
CC(=C)Cc1cccc(c1)OC(=O)C
Properties
Complexity:
220
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.099g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
190.242g/mol
Monoisotopic Mass:
190.099g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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