N-Hydroxy-cyclopentanecarboxamidine

CAT: 0127-OR97353Size: 1 gDry Ice: NoHazardous: No

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CAT#:0127-OR97353Size:1 g

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CAS Number

99623-12-8

MDL Number

MFCD03426265

Purity

95%

Smiles

ONC(=N)C1CCCC1

Chemical Information

N-Hydroxycyclopentanecarboximidamide

See also: N'-hydroxycyclopentanecarboximidamide (preferred).

CAS Number	99623-12-8
PubChem CID	14801676
IUPAC Name	N'-hydroxycyclopentanecarboximidamide
Molecular Formula	C6H12N2O
Molecular Weight	128.17
XLogP	0.9
Topological Polar Surface Area	58.6
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Heavy Atom Count	9
Formal Charge	0
Complexity	116

SMILES

C1CCC(C1)/C(=N/O)/N

InChI

InChI=1S/C6H12N2O/c7-6(8-9)5-3-1-2-4-5/h5,9H,1-4H2,(H2,7,8)

InChIKey

FJABAFACLDVRTR-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 99623-12-8

CID: 14801676

Formula: C6H12N2O

MW: 128.17

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	128.17
XLogP3	0.9
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	128.094963011
Monoisotopic Mass	128.094963011
Topological Polar Surface Area	58.6 Å²
Heavy Atom Count	9
Formal Charge	0
Complexity	116
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

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