N-Hydroxybenzamide

CAT: 0127-OR346449-01Size: 100 gDry Ice: NoHazardous: No

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CAT#:0127-OR346449-01Size:100 g

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CAS Number

495-18-1

MDL Number

MFCD00002109

Purity

60%

Smiles

ONC(=O)c1ccccc1

Chemical Information

Benzohydroxamic acid

Rhombic crystals or light beige solid. (NTP, 1992)

CAS Number	495-18-1
PubChem CID	10313
IUPAC Name	N-hydroxybenzamide
Molecular Formula	C7H7NO2
Molecular Weight	137.14
XLogP	0.3
Topological Polar Surface Area	49.3
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Heavy Atom Count	10
Formal Charge	0
Complexity	119

SMILES

C1=CC=C(C=C1)C(=O)NO

InChI

InChI=1S/C7H7NO2/c9-7(8-10)6-4-2-1-3-5-6/h1-5,10H,(H,8,9)

InChIKey

VDEUYMSGMPQMIK-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 495-18-1

CID: 10313

Formula: C7H7NO2

MW: 137.14

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	137.14
XLogP3	0.3
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	137.047678466
Monoisotopic Mass	137.047678466
Topological Polar Surface Area	49.3 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	119
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
OR957704	N, N-Diethyl-4-hydroxybenzamide
OR957705	N, N-Diethyl-3-hydroxybenzamide
OR900651-01	N-Cyclopropyl-3-hydroxybenzamide
OR97804-01	N-Formyl-2-hydroxybenzamide
OR300528	N-Formyl-2-hydroxybenzamide
OR900653-01	N-Butyl-4-hydroxybenzamide
OR957694	N-Cyclopropyl-4-hydroxybenzamide
OR1027521-01	N-Benzyl-2-Hydroxybenzamide
OR1049141-01	N-Benzyl-4-hydroxybenzamide
OR908169	N-Butyl-3-hydroxybenzamide

Catalog	Name
QAA78904-01	N, N-Diethyl-3-hydroxybenzamide
EDA11931-01	N, N-Diethyl-4-hydroxybenzamide
BBA07105-01	4-Amino-N-hydroxybenzamide
CBA52279-01	N-Ethyl-4-hydroxybenzamide
458983-01	N-Ethyl-3-hydroxybenzamide
458435-01	N-Butyl-3-hydroxybenzamide
sc-355608A	N-cyclopropyl-2-hydroxybenzamide
sc-355614A	N-cyclopropyl-3-hydroxybenzamide
sc-355621	N-cyclopropyl-4-hydroxybenzamide
QAA78902-01	N-Benzyl-3-hydroxybenzamide