3-Bromocyclobutanone - CAS 23761-24-2

Catalog:	BB018172
Product Name:	3-Bromocyclobutanone
CAS:	23761-24-2
Synonyms:	3-bromo-1-cyclobutanone; 3-bromocyclobutan-1-one

Technical Data

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Computed Properties

IUPAC Name:	3-bromocyclobutan-1-one
Description:	3-Bromocyclobutanone (CAS# 23761-24-2) is a useful research chemical.
Molecular Weight:	148.99
Molecular Formula:	C4H5BrO
Canonical SMILES:	C1C(CC1=O)Br
InChI:	InChI=1S/C4H5BrO/c5-3-1-4(6)2-3/h3H,1-2H2
InChI Key:	SMBXPJHSQKKYFY-UHFFFAOYSA-N
Appearance:	Solid
MDL:	MFCD20622640
LogP:	1.11280

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Related Functional Groups

Carbonyl Compounds

[89908-23-6]
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[17746-05-3]
Undecanoyl chloride
[35153-16-3]
(Z)-10-Tetradecenyl Acetate
[1035840-45-9]
1-(5-Methoxy-1,3-benzoxazol-2-yl)piperidine-3-carboxylic acid
[1006443-01-1]
1-(5-Nitropyridin-2-yl)-1H-pyrazole-3-carboxylic acid
[956439-56-8]
1-(Carboxymethyl)-3-nitro-1H-pyrazole-5-carboxylic acid

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GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P272, P280, P301+P312, P302+P352, P305+P351+P338, P321, P330, P333+P313, P337+P313, P363, and P501
Signal Word:	Warning

Complexity:	71.6
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	147.95238
Formal Charge:	0
Heavy Atom Count:	6
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	147.95238
Rotatable Bond Count:	0
Topological Polar Surface Area:	17.1 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.5