(3-Bromo-4-chlorophenyl) (phenyl) methanol

CAT: 0926-WLC95877-01Size: 50 mgDry Ice: NoHazardous: No

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CAT#:0926-WLC95877-01Size:50 mg

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CAS Number

1546958-77-3

MDL Number

MFCD23678876

Smiles

C1=CC=C (C=C1) C (C2=CC (=C (C=C2) Cl) Br) O

Molecular Formula

C13H10BrClO

Molecular Weight

297.57 g/mol

Controlled

Chemical Information

(3-Bromo-4-chlorophenyl)(phenyl)methanol

CAS Number	1546958-77-3
PubChem CID	115566447
IUPAC Name	(3-bromo-4-chlorophenyl)-phenylmethanol
Molecular Formula	C13H10BrClO
Molecular Weight	297.57
XLogP	4.1
Topological Polar Surface Area	20.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	2
Heavy Atom Count	16
Formal Charge	0
Complexity	218

SMILES

C1=CC=C(C=C1)C(C2=CC(=C(C=C2)Cl)Br)O

InChI

InChI=1S/C13H10BrClO/c14-11-8-10(6-7-12(11)15)13(16)9-4-2-1-3-5-9/h1-8,13,16H

InChIKey

GPRDPOCYKSCAPJ-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1546958-77-3

CID: 115566447

Formula: C13H10BrClO

MW: 297.57

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	297.57
XLogP3	4.1
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	2
Exact Mass	295.96036
Monoisotopic Mass	295.96036
Topological Polar Surface Area	20.2 Å²
Heavy Atom Count	16
Formal Charge	0
Complexity	218
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
YFB87239-01	[3- (4-Chlorophenyl) phenyl]methanol
NCA01203-01	(3-Chlorophenyl) (phenyl) methanol
SDC00584-01	[3-Bromo-4- (difluoromethoxy) phenyl]methanol
USC85031-01	[3-Bromo-4- (morpholin-4-yl) phenyl]methanol
RSC75622-01	[2-Bromo-4- (ethylsulfanyl) phenyl]methanol
EEA31794	(3-Amino-4-chlorophenyl) methanol
SZB82257-01	(2-Bromo-6-chlorophenyl) methanol
TBA17149-01	(2-Chlorophenyl) (4-chlorophenyl) methanol
RDA50365-01	(4-Chlorophenyl) [3- (trifluoromethyl) phenyl]methanone
XTB07661-01	(4-Chlorophenyl) [3- (difluoromethoxy) phenyl]methanone

Catalog	Name
OR1084541-01	(3-bromo-4-chlorophenyl) (phenyl) methanol
OR1084480-01	(2-bromo-4-chlorophenyl) (phenyl) methanol
OR1081608-01	(4-bromo-2-chlorophenyl) (phenyl) methanol
OR1098830-01	(3-bromo-5-chlorophenyl) (phenyl) methanol
OR1097077-01	(3-bromo-2-chlorophenyl) (phenyl) methanol
AL BD 1239-01	[4- (4-chlorophenyl) phenyl]methanol
TRC-B405168-100MG	(3-Chlorophenyl)(phenyl)methanol
OR1006635-01	(3-Chlorophenyl) (phenyl) methanol
PC1009199-01	(4-chlorophenyl) (3- (trifluoromethyl) phenyl) methanol
OR1082636-01	(2-bromo-6-chlorophenyl) (phenyl) methanol