2'- (4-bromobenzyloxy) acetophenone

CAT: 0024-sc-322107Size: 5 gDry Ice: NoHazardous: No

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CAT#:0024-sc-322107Size:5 g

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CAS Number

845866-47-9

Chemical Information

2'-(4-Bromobenzyloxy)acetophenone

CAS Number	845866-47-9
PubChem CID	2756843
IUPAC Name	1-[2-[(4-bromophenyl)methoxy]phenyl]ethanone
Molecular Formula	C15H13BrO2
Molecular Weight	305.17
XLogP	3.8
Topological Polar Surface Area	26.3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	4
Heavy Atom Count	18
Formal Charge	0
Complexity	272

SMILES

CC(=O)C1=CC=CC=C1OCC2=CC=C(C=C2)Br

InChI

InChI=1S/C15H13BrO2/c1-11(17)14-4-2-3-5-15(14)18-10-12-6-8-13(16)9-7-12/h2-9H,10H2,1H3

InChIKey

RUXZKHRTPJWTTB-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 845866-47-9

CID: 2756843

Formula: C15H13BrO2

MW: 305.17

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	305.17
XLogP3	3.8
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	4
Exact Mass	304.00989
Monoisotopic Mass	304.00989
Topological Polar Surface Area	26.3 Å²
Heavy Atom Count	18
Formal Charge	0
Complexity	272
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
sc-323289	4'- (4-Bromobenzyloxy) acetophenone
sc-323289A	4'- (4-Bromobenzyloxy) acetophenone
sc-320038	1- (4-Bromobenzyloxy) -2,5-difluorobenzene
sc-232224	4- (4-Bromobenzyloxy) benzaldehyde
sc-267829	4'- (2-Chloroethyl) acetophenone
sc-323284	4'- (2-Fluorophenoxy) acetophenone
sc-259246A	2- (4-Toluenesulphonyl) acetophenone
sc-206324	2- (4-Methoxyphenyl) acetophenone
sc-259246	2- (4-Toluenesulphonyl) acetophenone
sc-323285	4'- (2,4-difluorophenoxy) acetophenone

Catalog	Name
BRA89283-01	4'- (Pentafluorosulfur) acetophenone
TRC-M329080-1G	4-(Methylsulfonyl)acetophenone
PC7433E-01	4'- (Trifluoromethoxy) acetophenone
PC8042-01	4'- (Trifluoromethylthio) acetophenone
PC6195-01	4'- (Trifluoroacetyl) acetophenone
OR1654-01	4'- (Benzyloxy) acetophenone
FA72057-01	4-Acetophenone oxime
abx183479-01	4-(Trifluoromethyl)acetophenone
OR8170-01	4'- (Ethylsulphonyl) acetophenone
OR1543	4'- (Methylsulphonyl) acetophenone