N-Benzyl-4-hydroxybenzamide

CAT: 0127-OR1049141-01Size: 100 mgDry Ice: NoHazardous: No

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CAT#:0127-OR1049141-01Size:100 mg

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CAS Number

33901-20-1

MDL Number

MFCD01017285

Purity

95%

Smiles

OC1=CC=C(C(NCC2=CC=CC=C2)=O)C=C1

Chemical Information

N-benzyl-4-hydroxybenzamide

CAS Number	33901-20-1
PubChem CID	725068
IUPAC Name	N-benzyl-4-hydroxybenzamide
Molecular Formula	C14H13NO2
Molecular Weight	227.26
XLogP	1.9
Topological Polar Surface Area	49.3
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	3
Heavy Atom Count	17
Formal Charge	0
Complexity	241

SMILES

C1=CC=C(C=C1)CNC(=O)C2=CC=C(C=C2)O

InChI

InChI=1S/C14H13NO2/c16-13-8-6-12(7-9-13)14(17)15-10-11-4-2-1-3-5-11/h1-9,16H,10H2,(H,15,17)

InChIKey

FVQDRWUYZFPHLU-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 33901-20-1

CID: 725068

Formula: C14H13NO2

MW: 227.26

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	227.26
XLogP3	1.9
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	3
Exact Mass	227.094628657
Monoisotopic Mass	227.094628657
Topological Polar Surface Area	49.3 Å²
Heavy Atom Count	17
Formal Charge	0
Complexity	241
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
OR1027521-01	N-Benzyl-2-Hydroxybenzamide
OR1052495-01	N-Benzyl-3-hydroxybenzamide
OR957694	N-Cyclopropyl-4-hydroxybenzamide
OR900653-01	N-Butyl-4-hydroxybenzamide
OR88609-01	4-Amino-N-hydroxybenzamide
OR90771	4-Iodo-N-hydroxybenzamide
OR79910	4-Bromo-N-hydroxybenzamide
OR79946-01	4-Chloro-N-hydroxybenzamide
OR957574	N-Ethyl-4-hydroxybenzamide
OR957704	N, N-Diethyl-4-hydroxybenzamide

Catalog	Name
QAA78902-01	N-Benzyl-3-hydroxybenzamide
BMA52854-01	2-Amino-N-benzyl-5-hydroxybenzamide
BBA07105-01	4-Amino-N-hydroxybenzamide
CBA52279-01	N-Ethyl-4-hydroxybenzamide
sc-355621	N-cyclopropyl-4-hydroxybenzamide
458438-01	N-Butyl-4-hydroxybenzamide
EDA11931-01	N, N-Diethyl-4-hydroxybenzamide
TRC-H807515-5G	4-Hydroxybenzamide
sc-354225	N- (2-aminoethyl) -4-hydroxybenzamide
DXC60037-01	4- (Aminomethyl) -N-hydroxybenzamide hydrochloride