Gliquidone Impurity 30

CAT: 1299-RM-G121730-01Size: 10 mgDry Ice: NoHazardous: No

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CAT#:1299-RM-G121730-01Size:10 mg

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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CAS Number

5817-68-5

Synonyms

Methyl cyclohexylcarbamate

Molecular Formula

C8H15NO2

Molecular Weight

157.21

Target Alternative Name

Gliquidone

Product Name Synonym

Methyl cyclohexylcarbamate

Chemical Information

Methyl cyclohexylcarbamate

CAS Number	5817-68-5
PubChem CID	97437
IUPAC Name	methyl N-cyclohexylcarbamate
Molecular Formula	C8H15NO2
Molecular Weight	157.21
XLogP	1.8
Topological Polar Surface Area	38.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Heavy Atom Count	11
Formal Charge	0
Complexity	130

SMILES

COC(=O)NC1CCCCC1

InChI

InChI=1S/C8H15NO2/c1-11-8(10)9-7-5-3-2-4-6-7/h7H,2-6H2,1H3,(H,9,10)

InChIKey

BUIPKGZDEMXJLW-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 5817-68-5

CID: 97437

Formula: C8H15NO2

MW: 157.21

Interactive 3D Structure

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Computed Properties

Property	Value
Molecular Weight	157.21
XLogP3	1.8
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Exact Mass	157.110278721
Monoisotopic Mass	157.110278721
Topological Polar Surface Area	38.3 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	130
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