6-Bromo-3,4-dihydro-2(1H)-naphthalenone - CAS 4133-35-1

Name: 6-Bromo-3,4-dihydro-2(1H)-naphthalenone
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB024858
Product Name:	6-Bromo-3,4-dihydro-2(1H)-naphthalenone
CAS:	4133-35-1
Synonyms:	6-bromo-3,4-dihydro-1H-naphthalen-2-one

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Computed Properties

IUPAC Name:	6-bromo-3,4-dihydro-1H-naphthalen-2-one
Description:	6-Bromo-3,4-dihydro-2(1H)-naphthalenone (CAS# 4133-35-1) is a useful research chemical.
Molecular Weight:	225.08
Molecular Formula:	C10H9BrO
Canonical SMILES:	C1CC2=C(CC1=O)C=CC(=C2)Br
InChI:	InChI=1S/C10H9BrO/c11-9-3-1-8-6-10(12)4-2-7(8)5-9/h1,3,5H,2,4,6H2
InChI Key:	BYHKDUFPSJWJDI-UHFFFAOYSA-N
Boiling Point:	319.2 °C at 760 mmHg
Purity:	98 %
Density:	1.511 g/cm³
Appearance:	White to tan solid
MDL:	MFCD00239388
LogP:	2.50690

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Related Functional Groups

Carbonyl Compounds

[89908-23-6]C23H22N2O5
2-Propenoic acid, 2-(3',3'-dimethyl-6-nitrospiro[2H-1-benzopyran-2,2'-[2H]indol]-1'(3'H)-yl)ethyl ester
[55441-25-3]C8H7N3O
1-(2-Cyanophenyl)urea
[956439-56-8]C6H5N3O6
1-(Carboxymethyl)-3-nitro-1H-pyrazole-5-carboxylic acid
[70912-52-6]C10H13NO4
1,3-Dioxane-4,6-dione,2,2-dimethyl-5-(2-pyrrolidinylidene)-
[2168559-63-3]C8H10ClNO2
2-(6-Methyl-2-pyridyl)acetic Acid Hydrochloride
[865774-78-3]C16H21F2NO2
2-(6,8-difluoro-1,2,3,4-tetrahydro-naphthalen-2-ylamino)-pentanoic acid methyl ester

GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Publication Number	Title	Priority Date
WO-2021097061-A1	Antimicrobial compounds and methods	20191113
WO-2021087181-A1	Substituted pyrazole compounds as toll receptor inhibitors	20191101
US-2020176685-A1	Organic optoelectronic device and display device	20181204
WO-2020067657-A1	Composition for organic optoelectronic element, organic optoelectronic element, and display device	20180927
WO-2020033707-A1	Carboxamides as ubiquitin-specific protease inhibitors	20180809

Complexity:	190
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	223.98368
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	223.98368
Rotatable Bond Count:	0
Topological Polar Surface Area:	17.1 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.3