Benzyl 4-Hydroxybenzoate

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Catalog Number
ACM94188
Product Name
Benzyl 4-Hydroxybenzoate
Structure
Structure
CAS
94-18-8
Category
Heterocyclic Organic Compound
Synonyms
Benzylparaben
IUPAC Name
Benzyl 4-hydroxybenzoate
Molecular Weight
228.24
Molecular Formula
C14H12O3
Canonical SMILES
C1=CC=C(C=C1)COC(=O)C2=CC=C(C=C2)O
InChI
InChI=1S/C14H12O3/c15-13-8-6-12(7-9-13)14(16)17-10-11-4-2-1-3-5-11/h1-9,15H,10H2
InChI Key
MOZDKDIOPSPTBH-UHFFFAOYSA-N
Boiling Point
170 ºC
Melting Point
109-112 ºC
Density
1.1799 g/ml
Appearance
Powder
Complexity
238
Covalently-Bonded Unit Count
1
EC Number
202-311-9
Exact Mass
228.078644g/mol
Formal Charge
0
H-Bond Acceptor
3
H-Bond Donor
1
Heavy Atom Count
17
LogP
3.56 (LogP)
Monoisotopic Mass
228.078644g/mol
NSC Number
8080
Physical State
Solid
Rotatable Bond Count
4
UNII
8Y41DYV4VG
XLogP3
3.6
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