Cyclopropyl (4-bromophenyl) methanol

CAT: 0926-VCA28939-01Size: 0.5 gDry Ice: NoHazardous: No

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CAT#:0926-VCA28939-01Size:0.5 g

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CAS Number

70289-39-3

MDL Number

MFCD00019251

Smiles

C1CC1C (C2=CC=C (C=C2) Br) O

Molecular Formula

C10H11BrO

Molecular Weight

227.1 g/mol

Controlled

Chemical Information

(4-Bromophenyl)(cyclopropyl)methanol

CAS Number	70289-39-3
PubChem CID	123566
IUPAC Name	(4-bromophenyl)-cyclopropylmethanol
Molecular Formula	C10H11BrO
Molecular Weight	227.10
XLogP	2.5
Topological Polar Surface Area	20.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	2
Heavy Atom Count	12
Formal Charge	0
Complexity	148

SMILES

C1CC1C(C2=CC=C(C=C2)Br)O

InChI

InChI=1S/C10H11BrO/c11-9-5-3-8(4-6-9)10(12)7-1-2-7/h3-7,10,12H,1-2H2

InChIKey

PLVQKMYLBFYJHT-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 70289-39-3

CID: 123566

Formula: C10H11BrO

MW: 227.10

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	227.10
XLogP3	2.5
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	2
Exact Mass	225.99933
Monoisotopic Mass	225.99933
Topological Polar Surface Area	20.2 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	148
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
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RYB21903-01	(4-Bromophenyl) (cyclobutyl) methanol
UIA71734-01	Cyclobutyl (cyclopropyl) methanol
IYB91557-01	(1- (4-Bromophenyl) cyclopropyl) methanamine hydrochloride
CHC37906-01	{1-[ (4-Chlorophenyl) methyl]cyclopropyl}methanol
LUD67881-01	[1- (4-Aminophenyl) cyclopropyl]methanol hydrochloride
ZZB95165-01	Cyclopropyl (4-methoxy-2-methylphenyl) methanol
GXB60068-01	Cyclopropyl (4-fluoro-3-methylphenyl) methanol
CHC38105-01	{1-[ (4-Fluorophenyl) methyl]cyclopropyl}methanol
FDD49924-01	{1-[ (4-Bromophenyl) methyl]cyclopropyl}methanamine hydrochloride

Catalog	Name
OR1056046-01	(4-Bromophenyl) (cyclopropyl) methanol
TRC-B686480-1G	[1-(4-Bromophenyl)cyclopropyl]methanol
sc-206105	[1- (4-Bromophenyl) cyclopropyl]methanol
PC32710	Cyclopropyl (4-fluorophenyl) methanol
OR1091472-01	Cyclopropyl (4-isobutoxyphenyl) methanol
OR1090325-01	(4-Cyclopropyl-2-methylphenyl) methanol
OR77788-01	(1- (4-Methoxyphenyl) cyclopropyl) methanol
PC32405	Cyclopropyl[di (4-fluorophenyl) ]methanol
PC449013-01	[1- (4-Trifluoromethylphenyl) cyclopropyl]methanol
PC1011177-01	(3-cyclopropyl-4-fluorophenyl) methanol