1-Bromocyclopropanecarboxamide

CAT: 0127-OR90026-01Size: 1 gDry Ice: NoHazardous: No

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CAT#:0127-OR90026-01Size:1 g

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CAS Number

198758-97-3

MDL Number

MFCD23701749

Purity

97%

Smiles

O=C(C1(Br)CC1)N

Chemical Information

1-Bromocyclopropane-1-carboxamide

CAS Number	198758-97-3
PubChem CID	21350881
IUPAC Name	1-bromocyclopropane-1-carboxamide
Molecular Formula	C4H6BrNO
Molecular Weight	164.00
XLogP	0.3
Topological Polar Surface Area	43.1
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	1
Heavy Atom Count	7
Formal Charge	0
Complexity	108

SMILES

C1CC1(C(=O)N)Br

InChI

InChI=1S/C4H6BrNO/c5-4(1-2-4)3(6)7/h1-2H2,(H2,6,7)

InChIKey

RZWDXSFZQLTCTN-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 198758-97-3

CID: 21350881

Formula: C4H6BrNO

MW: 164.00

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	164.00
XLogP3	0.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	1
Exact Mass	162.96328
Monoisotopic Mass	162.96328
Topological Polar Surface Area	43.1 Å²
Heavy Atom Count	7
Formal Charge	0
Complexity	108
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
BUP12620-01	1,1,1,1-Kestohexaose
OR300179	1-Isothiocyanatobicyclo[1.1.1]pentane
OR300174	1-Isocyanatobicyclo[1.1.1]pentane
PC01657-01	1,1,1-Trifluorohexane
PC106393	1,1,1-Trifluorodecane
PC53034	1,1,1-Trifluoropentane
OR16079-01	1,1,1-Trichloroacetone
PC7180-01	1,1,1-Trifluoroacetone
PC106394	1,1,1-Trifluorooctane
PC450209-01	1,1,1-Tribromotrifluoroacetone

Catalog	Name
YHA75897	1-Bromocyclopropanecarboxamide
OF59775-01	1,1,1,1,1-Kestoheptaose
OK59466-01	1,1,1,1-Kestohexose
GTR19169514-01	1,1,1,1-Kestohexaose
TRC-T773995-100MG	1,1,1-Trichloromethanesulfonic Acid 1,1'-Anhydride
HY-157129	AMPK-α1β1γ1 activator 1
DFA88480-01	1-Bromobicyclo[1.1.1]pentane
FT77421-01	1,1,1-Trifluorobutane
T40476	1,1,1-Tribromoacetone
297269-01	1,1,1-Kestopentaose