4-Hydroxycyclohexane-1-carboxamide

CAT: 0926-REA94110-01Size: 50 mgDry Ice: NoHazardous: No

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CAT#:0926-REA94110-01Size:50 mg

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CAS Number

116941-10-7

MDL Number

MFCD15209564

Smiles

C1CC (CCC1C (=O) N) O

Molecular Formula

C7H13NO2

Molecular Weight

143.19 g/mol

Controlled

Chemical Information

4-Hydroxycyclohexane-1-carboxamide

CAS Number	116941-10-7
PubChem CID	14022790
IUPAC Name	4-hydroxycyclohexane-1-carboxamide
Molecular Formula	C7H13NO2
Molecular Weight	143.18
XLogP	-0.3
Topological Polar Surface Area	63.3
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Heavy Atom Count	10
Formal Charge	0
Complexity	128

SMILES

C1CC(CCC1C(=O)N)O

InChI

InChI=1S/C7H13NO2/c8-7(10)5-1-3-6(9)4-2-5/h5-6,9H,1-4H2,(H2,8,10)

InChIKey

UCUHQXIAXJMZRI-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 116941-10-7

CID: 14022790

Formula: C7H13NO2

MW: 143.18

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	143.18
XLogP3	-0.3
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	143.094628657
Monoisotopic Mass	143.094628657
Topological Polar Surface Area	63.3 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	128
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
HAA50069-01	1-Hydroxycyclohexane-1-carboxamide
GGB56943-01	1-Hydroxycyclohexane-1-carboximidamide
PED67225-01	4- (Aminomethyl) -4-hydroxycyclohexane-1-carboxylic acid hydrochloride
ZAA05633-01	3-Hydroxycyclohexane-1-carbonitrile
UFC98768-01	4-Hydroxynaphthalene-1-carboxamide
GJB75875-01	4-Aminocyclohexane-1-carboxamide
GMA97642-01	4-Oxopiperidine-1-carboxamide
FWA12027-01	1-Acetylpiperidine-4-carboxamide
ELA23812-01	4-Hydroxypiperidine-1-carboxamide
GAA18354-01	Methyl cis-3-hydroxycyclohexane-1-carboxylate

Catalog	Name
JH248755	1-CHLORO-4-HYDROXYCYCLOHEXANE
OR908004-01	Ethyl 4-hydroxycyclohexane-1-carboxylate
OR27594-01	Methyl 4-hydroxycyclohexane-1-carboxylate
OR480604-01	N-Cbz-4-hydroxycyclohexane
OR40634-01	Trans-4-Hydroxycyclohexane-1-carboxylic acid
OR1001185-01	Cis-tert-Butyl-4-hydroxycyclohexane-1-carboxylate
TRC-H950113-250MG	3-Hydroxycyclohexane-1-carboxylic acid
GTR19253261-01	2-Hydroxycyclohexane-1-carboxyl-CoA
OR315067-01	1,4'-Bipiperidine-4-carboxamide
OR30386	Dimethyl 2-hydroxycyclohexane-1,3-dicarboxylate