Irbesartan Impurity 36

CAT: 1299-RM-I192036-01Size: 10 mgDry Ice: NoHazardous: No

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CAT#:1299-RM-I192036-01Size:10 mg

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CAS Number

17193-28-1

Synonyms

1-aminocyclopentanecarboxamide

Molecular Formula

C6H12N2O

Molecular Weight

128.17

Target Alternative Name

Irbesartan

Product Name Synonym

1-aminocyclopentanecarboxamide

Chemical Information

1-Aminocyclopentanecarboxamide

CAS Number	17193-28-1
PubChem CID	11116086
IUPAC Name	1-aminocyclopentane-1-carboxamide
Molecular Formula	C6H12N2O
Molecular Weight	128.17
XLogP	-1
Topological Polar Surface Area	69.1
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Heavy Atom Count	9
Formal Charge	0
Complexity	127

SMILES

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

InChI

InChI=1S/C6H12N2O/c7-5(9)6(8)3-1-2-4-6/h1-4,8H2,(H2,7,9)

InChIKey

YGVGITVCEHRBDK-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 17193-28-1

CID: 11116086

Formula: C6H12N2O

MW: 128.17

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	128.17
XLogP3	-1
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	69.1 Å²
Heavy Atom Count	9
Formal Charge	0
Complexity	127
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
AR-I01690-01	Irbesartan Impurity 10 (Irbesartan dimer)
JH915213	Irbesartan Impurity 14
AR-I01700-01	Irbesartan Impurity 11
AR-I01697-01	Irbesartan Impurity 4
AR-I01691-01	Irbesartan Impurity 7
AR-I01694-01	Irbesartan Impurity 1
AR-I03896-01	Irbesartan Impurity 23
AR-I03893-01	Irbesartan Impurity 41
AR-I03890-01	Irbesartan Impurity 37
AR-I01698-01	Irbesartan Impurity 5