Home Other Building Blocks 2-Propenoic acid, 2-methyl-, 4-benzoyl-3-hydroxyphenyl ester

2-Propenoic acid, 2-methyl-, 4-benzoyl-3-hydroxyphenyl ester

CAS No.:
2035-72-5
Catalog Number:
AG0028XP
Molecular Formula:
C17H14O4
Molecular Weight:
282.2907
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Product Description
Catalog Number:
AG0028XP
Chemical Name:
2-Propenoic acid, 2-methyl-, 4-benzoyl-3-hydroxyphenyl ester
CAS Number:
2035-72-5
Molecular Formula:
C17H14O4
Molecular Weight:
282.2907
MDL Number:
MFCD00080561
IUPAC Name:
(4-benzoyl-3-hydroxyphenyl) 2-methylprop-2-enoate
InChI:
InChI=1S/C17H14O4/c1-11(2)17(20)21-13-8-9-14(15(18)10-13)16(19)12-6-4-3-5-7-12/h3-10,18H,1H2,2H3
InChI Key:
IMNBHNRXUAJVQE-UHFFFAOYSA-N
SMILES:
CC(=C)C(=O)Oc1ccc(c(c1)O)C(=O)c1ccccc1
EC Number:
218-000-6
Properties
Complexity:
409  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
282.089g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
282.295g/mol
Monoisotopic Mass:
282.089g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
63.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2  
Properties