3-Bromo-2',5-dichloro-2-hydroxybenzophenone

CAT: 0127-OR1129Size: 1 EachDry Ice: NoHazardous: No

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CAS Number

332104-57-1

MDL Number

MFCD02683002

Smiles

Oc1c (Br) cc (Cl) cc1C (=O) c2ccccc2Cl

Chemical Information

3-Bromo-2',5-dichloro-2-hydroxybenzophenone

CAS Number	332104-57-1
PubChem CID	689070
IUPAC Name	(3-bromo-5-chloro-2-hydroxyphenyl)-(2-chlorophenyl)methanone
Molecular Formula	C13H7BrCl2O2
Molecular Weight	346.0
XLogP	5.4
Topological Polar Surface Area	37.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Heavy Atom Count	18
Formal Charge	0
Complexity	313

SMILES

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

InChI

InChI=1S/C13H7BrCl2O2/c14-10-6-7(15)5-9(13(10)18)12(17)8-3-1-2-4-11(8)16/h1-6,18H

InChIKey

YDOASFSKJSZNAO-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 332104-57-1

CID: 689070

Formula: C13H7BrCl2O2

MW: 346.0

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	346.0
XLogP3	5.4
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Exact Mass	343.90065
Monoisotopic Mass	343.90065
Topological Polar Surface Area	37.3 Å²
Heavy Atom Count	18
Formal Charge	0
Complexity	313
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
OR1134-01	2',5-Dichloro-2-hydroxybenzophenone
OR1131-01	5-Bromo-2-hydroxybenzophenone
OR1127	3-Bromo-5-chloro-2-hydroxybenzophenone
OR1128-01	5-Bromo-2'-chloro-2-hydroxybenzophenone
PC6505	4'-Bromo-5-fluoro-2-hydroxybenzophenone
PC6503	5-Fluoro-2-hydroxybenzophenone
PC1026812-01	5-bromo-3,4-dichloro-2-fluorobenzaldehyde
OR1095686	1-Bromo-3,5-dichloro-2-iodobenzene
OR1047225-01	5-Bromo-1,2-dichloro-3-methoxybenzene
OR1099578-01	1-Bromo-2,5-dichloro-3-isopropoxybenzene

Catalog	Name
sc-231506	3-Bromo-2',5-dichloro-2-hydroxybenzophenone
sc-231268	2',5-Dichloro-2-hydroxybenzophenone
266241-01	5-Bromo-2-hydroxybenzophenone
sc-251970	3-Bromo-5-chloro-2-hydroxybenzophenone
sc-233284	5-Bromo-2'-chloro-2-hydroxybenzophenone
233964-01	5-Bromo-2-hydroxybenzophenone 99+% (HPLC)
270725-01	3,5-Dichloro-2-bromo pyridine
TRC-C368250-100MG	5-Chloro-2-hydroxybenzophenone
261144-01	2-Amino-5-chloro-3'-hydroxybenzophenone
KCA63326-01	1-Bromo-3,5-dichloro-2-methoxybenzene