(3,5-dibromophenyl) (phenyl) methanol

CAT: 0127-OR1092599-01Size: 250 mgDry Ice: NoHazardous: No

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CAT#:0127-OR1092599-01Size:250 mg

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CAS Number

51339-31-2

MDL Number

MFCD27979430

Purity

97%

Smiles

C1cccc (c1) C (c1cc (cc (c1) Br) Br) O

Chemical Information

(3,5-Dibromophenyl)(phenyl)methanol

CAS Number	51339-31-2
PubChem CID	9927984
IUPAC Name	(3,5-dibromophenyl)-phenylmethanol
Molecular Formula	C13H10Br2O
Molecular Weight	342.02
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	206

SMILES

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

InChI

InChI=1S/C13H10Br2O/c14-11-6-10(7-12(15)8-11)13(16)9-4-2-1-3-5-9/h1-8,13,16H

InChIKey

BXWPEMCVLZVRMW-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 51339-31-2

CID: 9927984

Formula: C13H10Br2O

MW: 342.02

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	342.02
XLogP3	4.1
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	2
Exact Mass	341.90779
Monoisotopic Mass	339.90984
Topological Polar Surface Area	20.2 Å²
Heavy Atom Count	16
Formal Charge	0
Complexity	206
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
OR1082021-01	(2,5-dibromophenyl) (phenyl) methanol
OR1098243-01	(3,5-dibromophenyl) (phenyl) methanone
PC1015059-01	(3,5-dibromophenyl) (3-fluorophenyl) methanol
OR95711-01	(2,5-Dibromophenyl) methanol
OR1088697	[4- (Benzyloxy) -3,5-dibromophenyl]methanol
OR1056336-01	(4-Amino-3,5-dibromophenyl) methanol
OR1093448-01	(3,4-dibromophenyl) methanol
OR1095554-01	(4-amino-3,5-dibromophenyl) (phenyl) methanone
OR1061614-01	(2,5-Dibromophenyl) (4-ethoxyphenyl) methanol
OR1062307-01	3- (3,5-Dibromophenyl) -9-phenyl-9H-carbazole

Catalog	Name
sc-299894	(5-Phenyl-3-isoxazolyl) methanol
GTR19252614-01	(3-Phenyl-5-isoxazolyl) methanol
AL BD 0660-01	[3- (3,5-dichlorophenoxy) phenyl]methanol
RMC40039-01	[3-Chloro-5- (ethanesulfonyl) phenyl]methanol
BSB90094-01	[3-Chloro-5- (methylamino) phenyl]methanol
DQB84394-01	[3-Methanesulfonyl-5- (trifluoromethyl) phenyl]methanol
DQB84386-01	[3- (Dimethylamino) -5- (trifluoromethyl) phenyl]methanol
sc-313662A	[3,5-Bis (methylsulfonyl) phenyl]methanol
LDA99798-01	[3- (Methylamino) phenyl] (phenyl) methanol
QLB70476-01	[3- (Ethylamino) phenyl]methanol