3-Ethoxy-N'-hydroxybenzenecarboximidamide

CAT: 0127-OR200121Size: 1 EachDry Ice: NoHazardous: No

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CAS Number

885957-55-1

MDL Number

MFCD09044051

Purity

=95%

Smiles

CCOc1cccc(c1)\C(=N\O)\N

Chemical Information

3-ethoxy-N'-hydroxybenzenecarboximidamide

CAS Number	885957-55-1
PubChem CID	16771740
IUPAC Name	3-ethoxy-N'-hydroxybenzenecarboximidamide
Molecular Formula	C9H12N2O2
Molecular Weight	180.20
XLogP	1.4
Topological Polar Surface Area	67.8
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	3
Heavy Atom Count	13
Formal Charge	0
Complexity	182

SMILES

CCOC1=CC=CC(=C1)/C(=N/O)/N

InChI

InChI=1S/C9H12N2O2/c1-2-13-8-5-3-4-7(6-8)9(10)11-12/h3-6,12H,2H2,1H3,(H2,10,11)

InChIKey

MVZKYWYFNAGECF-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 885957-55-1

CID: 16771740

Formula: C9H12N2O2

MW: 180.20

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	180.20
XLogP3	1.4
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	3
Exact Mass	180.089877630
Monoisotopic Mass	180.089877630
Topological Polar Surface Area	67.8 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	182
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
OR29902	4-chloro-N'-hydroxybenzenecarboximidamide
OR72177-01	2-Bromo-N'-hydroxybenzenecarboximidamide
OR29259	2-amino-3,5-dichloro-N'-hydroxybenzenecarboximidamide
OR29533-01	2,6-Dichloro-N'-hydroxybenzenecarboximidamide
OR27292	4- (1,3-dithiolan-2-yl) -N'-hydroxybenzenecarboximidamide
OR28424	2-amino-5-chloro-N'-hydroxybenzenecarboximidamide
PC105504	4-bromo-2-fluoro-N'-hydroxybenzenecarboximidamide
OR920744-01	3-Ethoxy-n, n-diethylaniline
PC210063	4-{[3-Chloro-5- (trifluoromethyl) -2-pyridinyl]oxy}-N'-hydroxybenzenecarboximidamide
OR25117	3-[ (4,5-Dichloro-1H-imidazol-1-yl) methyl]-N'-hydroxybenzenecarboximidamide

Catalog	Name
417512-01	2-Ethoxy-N'-hydroxybenzenecarboximidamide
sc-346582	3-bromo-N'-hydroxybenzenecarboximidamide
432436-01	4-Fluoro-N'-hydroxybenzenecarboximidamide
sc-349474	4-ethyl-N'-hydroxybenzenecarboximidamide
sc-348668A	4-[ (aminocarbonyl) amino]-N'-hydroxybenzenecarboximidamide
sc-275478	2,6-dichloro-N'-hydroxybenzenecarboximidamide
sc-299343A	4-[ (2-Fluorobenzyl) oxy]-N'-hydroxybenzenecarboximidamide
sc-486063	3-Ethoxy-N, N-diethylaniline
160561	3-Ethoxy-N, N-diethylbenzenamine
sc-310451A	3-[ (2-Chloro-1,3-thiazol-5-yl) methoxy]-N'-hydroxybenzenecarboximidamide