2- (4-Bromophenyl) acetophenone

CAT: 0127-OR1043176-02Size: 5 gDry Ice: NoHazardous: No

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CAT#:0127-OR1043176-02Size:5 g

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CAS Number

22421-88-1

Purity

97%

Smiles

Brc1ccc(cc1)CC(=O)c1ccccc1

Chemical Information

2-(4-Bromophenyl)-1-phenylethan-1-one

CAS Number	22421-88-1
PubChem CID	13459098
IUPAC Name	2-(4-bromophenyl)-1-phenylethanone
Molecular Formula	C14H11BrO
Molecular Weight	275.14
XLogP	3.9
Topological Polar Surface Area	17.1
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	3
Heavy Atom Count	16
Formal Charge	0
Complexity	225

SMILES

C1=CC=C(C=C1)C(=O)CC2=CC=C(C=C2)Br

InChI

InChI=1S/C14H11BrO/c15-13-8-6-11(7-9-13)10-14(16)12-4-2-1-3-5-12/h1-9H,10H2

InChIKey

GPTAKAWFMITEOL-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 22421-88-1

CID: 13459098

Formula: C14H11BrO

MW: 275.14

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	275.14
XLogP3	3.9
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	3
Exact Mass	273.99933
Monoisotopic Mass	273.99933
Topological Polar Surface Area	17.1 Å²
Heavy Atom Count	16
Formal Charge	0
Complexity	225
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
OR1046605-01	2- (4-Methoxyphenyl) acetophenone
BUP14138-01	4'- (2-Methylpropyl) acetophenone
PC10254	2'- (4-Fluorobenzyloxy) acetophenone
OR4544-01	2- (4-Toluenesulphonyl) acetophenone
OR24032	4'- (2,4-Dichlorophenoxy) acetophenone
PC421018	2- (4-Fluorophenyl) acetophenone
PC1021647-01	4- (2,4-Difluorophenyl) acetophenone
PC500946	4- (2,2-Difluoroethoxy) acetophenone
OR1081619-01	(2-bromophenyl) (4-bromophenyl) methanol
PC500856	4- (2,2,2-Trifluoroethoxy) acetophenone

Catalog	Name
sc-233091	4'- (4-Bromophenyl) acetophenone
22421-88-1-01	2- (4-Bromophenyl) acetophenone
BRA89283-01	4'- (Pentafluorosulfur) acetophenone
sc-323291A	4'- (Ethylthio) acetophenone
sc-262236	4'- (Ethylsulphonyl) acetophenone
sc-233093	4'- (Trifluoromethoxy) acetophenone
TRC-M329080-1G	4-(Methylsulfonyl)acetophenone
FA72057-01	4-Acetophenone oxime
abx183479-01	4-(Trifluoromethyl)acetophenone
GTR19252266	4'- (Methylsulfonyl) acetophenone