(4-Bromobutyl) cyclopropane

CAT: 0926-IEA29464-01Size: 100 mgDry Ice: NoHazardous: No

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CAT#:0926-IEA29464-01Size:100 mg

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CAS Number

108294-64-0

MDL Number

MFCD20623012

Smiles

C1CC1CCCCBr

Molecular Formula

C7H13Br

Molecular Weight

177.08 g/mol

Controlled

Chemical Information

(4-Bromobutyl)cyclopropane

CAS Number	108294-64-0
PubChem CID	13789860
IUPAC Name	4-bromobutylcyclopropane
Molecular Formula	C7H13Br
Molecular Weight	177.08
XLogP	3.4
Topological Polar Surface Area	0
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	4
Heavy Atom Count	8
Formal Charge	0
Complexity	57

SMILES

C1CC1CCCCBr

InChI

InChI=1S/C7H13Br/c8-6-2-1-3-7-4-5-7/h7H,1-6H2

InChIKey

MNOCGYQGBQULQR-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 108294-64-0

CID: 13789860

Formula: C7H13Br

MW: 177.08

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	177.08
XLogP3	3.4
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	4
Exact Mass	176.02006
Monoisotopic Mass	176.02006
Topological Polar Surface Area	0 Å²
Heavy Atom Count	8
Formal Charge	0
Complexity	57.4
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
FB155652-01	4-Bromobutyl acetate
ASB49676-01	4- (4-Bromobutyl) oxane
FB32709-01	N- (4-Bromobutyl) phthalimide
SAA37558-01	(4-Bromobutyl) dimethylamine hydrobromide
DXC58712-01	4- (4-Bromobutyl) morpholine Hydrobromide
IGA60705-01	1- (4-Bromobutyl) -4-chlorobenzene
GJB98873-01	(4-Bromobutyl) diethylamine hydrobromide
NDA99991-01	1-Bromo-4- (4-bromobutyl) benzene
TDC18684-01	4- (4-Bromobutyl) -1,2-dichlorobenzene
MHA33970-01	1- (4-Bromobutyl) pyrrolidine hydrobromide

Catalog	Name
OR1071637-01	(4-Bromobutylidene) cyclopropane
408086-01	1- (4-Chlorophenyl) cyclopropane-1-carboxamide
OR92707-01	1- (4-Nitrophenyl) cyclopropane-1-carbonitrile
OR84003-01	1- (4-Aminophenyl) cyclopropane-1-carbonitrile
OR1070785-01	4'-Bromospiro[cyclopropane-1,3'-indoline]
OR942695-01	1- (4-Hydroxyphenyl) cyclopropane-1-carbonitrile
408032-01	1- (4-Bromophenyl) cyclopropane-1-carbohydrazide
OR88292-01	1- (4-Bromophenyl) cyclopropane-1-carbaldehyde
OR60130-01	1- (4-Bromophenyl) cyclopropane-1-carbonitrile
sc-332837	1- (4-chlorophenyl) cyclopropane-1-carboxylic acid