N'-Cyanobenzenecarboximidamide

CAT: 0127-OR1002946-01Size: 250 mgDry Ice: NoHazardous: No

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CAT#:0127-OR1002946-01Size:250 mg

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CAS Number

17513-09-6

MDL Number

MFCD02728839

Purity

90%

Smiles

NC(=NC#N)c1ccccc1

Chemical Information

N'-Cyanobenzenecarboximidamide

CAS Number	17513-09-6
PubChem CID	270782
IUPAC Name	N'-cyanobenzenecarboximidamide
Molecular Formula	C8H7N3
Molecular Weight	145.16
XLogP	1.1
Topological Polar Surface Area	62.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Heavy Atom Count	11
Formal Charge	0
Complexity	193

SMILES

C1=CC=C(C=C1)C(=NC#N)N

InChI

InChI=1S/C8H7N3/c9-6-11-8(10)7-4-2-1-3-5-7/h1-5H,(H2,10,11)

InChIKey

JEWFJQWVHWGHOQ-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 17513-09-6

CID: 270782

Formula: C8H7N3

MW: 145.16

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	145.16
XLogP3	1.1
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	145.063997236
Monoisotopic Mass	145.063997236
Topological Polar Surface Area	62.2 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	193
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
OR9122-01	N, N, N', N', N'', N''-Hexamethylmethanetriamine
OR22662	N, N, N, N, N, N-hexaethylphosphinetricarboxamide
OR55651-01	N, N, N', N'', N''-Pentamethyldiethylenetriamine
OR1077740	N, N', N'', N''', N''''-Pentaacetylchitopentaose
OR1014057	N, N, N', N'-Tetraethylethylenediamine
OR1053301-01	N, N, N', N'-TEtraethylsulfamide
OR1014058-01	N, N, N', N'-Tetraethylmethanediamine
OR1014056-01	N, N, N, N-Tetramethyldiaminomethane
OR1044105-01	N, N', N'', N'''-Tetraacetylglycoluril
OR1037813-01	N, N, N', N'-Tetramethyloxamide

Catalog	Name
FC122839-01	N'-Cyanobenzenecarboximidamide hydrochloride
OH153454-01	N, N', N'', N''', N'''', N''''', N''''''-Heptaacetylchitoheptaose
297193-01	N, N', N'', N''', N'''', N'''''-Hexaacetylchitohexaose
TRC-H290750-10MG	N,N’,N’’,N’’’,N’’’’,N’’’’’-Hexaacetylchitohexaose
FH171463-01	N, N, N', N', N'', N''-Hexamethoxymethylmelamine
AR-O01213-01	N, N’, N’’, N’’’, N’’’’, N’’’’’-Hexaacetylchitohexaose
sc-255378	N, N, N', N'', N''-Pentamethyldiethylenetriamine
TRC-P225000-100MG	N,N’,N’’,N’’’,N’’’’-Pentaacetylchitopentaose
FT54997-01	N, N, N', N'-Tetraacetylethylenediamine
AAA15077-01	N, N, N', N'-Tetraethylethylenediamine