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13633-84-6

13633-84-6 | 2-Propenoic acid, 2-methylphenyl ester

CAS No: 13633-84-6 Catalog No: AG0011OB MDL No:

Product Description

Catalog Number:
AG0011OB
Chemical Name:
2-Propenoic acid, 2-methylphenyl ester
CAS Number:
13633-84-6
Molecular Formula:
C10H10O2
Molecular Weight:
162.1852
IUPAC Name:
(2-methylphenyl) prop-2-enoate
InChI:
InChI=1S/C10H10O2/c1-3-10(11)12-9-7-5-4-6-8(9)2/h3-7H,1H2,2H3
InChI Key:
GCIHZDWTJCGMDK-UHFFFAOYSA-N
SMILES:
C=CC(=O)Oc1ccccc1C
NSC Number:
72743

Properties

Complexity:
175  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
162.068g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
162.188g/mol
Monoisotopic Mass:
162.068g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  

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