Home Other Building Blocks 3-(2,4,5-trimethylphenyl)prop-2-enoic acid

3-(2,4,5-trimethylphenyl)prop-2-enoic acid

CAS No.:
205748-06-7
Catalog Number:
AG019N6U
Molecular Formula:
C12H14O2
Molecular Weight:
190.2384
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Product Description
Catalog Number:
AG019N6U
Chemical Name:
3-(2,4,5-trimethylphenyl)prop-2-enoic acid
CAS Number:
205748-06-7
Molecular Formula:
C12H14O2
Molecular Weight:
190.2384
MDL Number:
MFCD00075865
IUPAC Name:
(E)-3-(2,4,5-trimethylphenyl)prop-2-enoic acid
InChI:
InChI=1S/C12H14O2/c1-8-6-10(3)11(7-9(8)2)4-5-12(13)14/h4-7H,1-3H3,(H,13,14)/b5-4+
InChI Key:
OUSXTDXBZCOQIT-SNAWJCMRSA-N
SMILES:
Cc1cc(C)c(cc1C=CC(=O)O)C
Properties
Complexity:
233  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1  
Exact Mass:
190.099g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
190.242g/mol
Monoisotopic Mass:
190.099g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Properties