2-Chloro-N-hydroxyacetamidine

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CAS Number

3272-96-6

MDL Number

MFCD06673460

Purity

=95%

Smiles

N\C(=N/O)\CCl

Chemical Information

(1Z)-2-chloro-N'-hydroxyethanimidamide

See also: 2-chloro-N'-hydroxyethanimidamide (preferred).

CAS Number	3272-96-6
PubChem CID	6522025
IUPAC Name	2-chloro-N'-hydroxyethanimidamide
Molecular Formula	C2H5ClN2O
Molecular Weight	108.53
XLogP	0
Topological Polar Surface Area	58.6
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Heavy Atom Count	6
Formal Charge	0
Complexity	62

SMILES

C(/C(=N/O)/N)Cl

InChI

InChI=1S/C2H5ClN2O/c3-1-2(4)5-6/h6H,1H2,(H2,4,5)

InChIKey

XCARGDPHZYJCMU-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 3272-96-6

CID: 6522025

Formula: C2H5ClN2O

MW: 108.53

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	108.53
XLogP3	0
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	108.0090405
Monoisotopic Mass	108.0090405
Topological Polar Surface Area	58.6 Å²
Heavy Atom Count	6
Formal Charge	0
Complexity	62.6
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
PC109516-01	2- (2,6-Difluorophenyl) -N-hydroxyacetamidine
PC102215-01	2-Chloro-N- (2-chloro-6-fluorobenzyl) -N-methylacetamide
OR1001923-01	2-Chloro-n, n-diphenylacetamide
OR936656-01	2-Chloro-n, n-diethylaniline
OR52317-01	2-Chloro-N, N-diisobutylacetamide
OR956951-01	2-Chloro-n, n-dimethylaniline
OR1092171	2-Chloro-N, N-diethylnicotinamide
OR1055131-01	2-Chloro-N, N-dipropylacetamide
OR81541-01	2-Chloro-N, N-dimethylisonicotinamide
OR49017-01	2-Chloro-N, N-dimethylacetamide

Catalog	Name
459190-01	N-Hydroxyacetamidine
sc-341863	2-chloro-N- (2-chloro-6-fluorobenzyl) -N-methylacetamide
sc-341864A	2-Chloro-N- (2-chloro-acetyl) -benzamide
HAA40366-01	2-Chloro-N, N-diisopropylacetamide
417133-01	2-Chloro-N, N-diethylacetamide
sc-342566	2-chloro-N, N-dipropylacetamide
sc-342565	2-chloro-N, N-diisopropylpropanamide
sc-274720	2-chloro-N, N-dimethylpropanamide
sc-230189	2-Chloro-N, N-dimethylacetamide
FC127662-01	2-Chloro-N, N-diphenylacetamide