Flurbiprofen Impurity ⅳ

CAT: 1299-RM-F210614-01Size: 10 mgDry Ice: NoHazardous: No

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CAT#:1299-RM-F210614-01Size:10 mg

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CAS Number

92-66-0

Synonyms

4-bromo-1,1'-biphenyl

Molecular Formula

C12H9Br

Molecular Weight

233.1

Target Alternative Name

Flurbiprofen

Product Name Synonym

4-bromo-1,1'-biphenyl

Chemical Information

4-Bromobiphenyl

4-bromobiphenyl appears as colorless crystals. Insoluble in water. (NTP, 1992)

CAS Number	92-66-0
PubChem CID	7101
IUPAC Name	1-bromo-4-phenylbenzene
Molecular Formula	C12H9Br
Molecular Weight	233.10
XLogP	4.7
Topological Polar Surface Area	0
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	1
Heavy Atom Count	13
Formal Charge	0
Complexity	141

SMILES

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

InChI

InChI=1S/C12H9Br/c13-12-8-6-11(7-9-12)10-4-2-1-3-5-10/h1-9H

InChIKey

PKJBWOWQJHHAHG-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 92-66-0

CID: 7101

Formula: C12H9Br

MW: 233.10

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	233.10
XLogP3	4.7
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	1
Exact Mass	231.98876
Monoisotopic Mass	231.98876
Topological Polar Surface Area	0 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	141
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
RM-F210601-01	Flurbiprofen EP Impurity A
RM-F210605-01	Flurbiprofen EP Impurity E
RM-F210603-01	Flurbiprofen EP Impurity C
RM-F210604-01	Flurbiprofen EP Impurity D
RM-F210602-01	Flurbiprofen EP Impurity B
RM-F210664-01	S, S-Flurbiprofen EP Impurity B
RM-F210600-01	Flurbiprofen
RM-F210641-01	Flurbiprofen-D3
RM-F210645-01	(S) -Flurbiprofen
RM-F210646-01	(R) -Flurbiprofen