Evocalcet Impurity 7

CAT: 1596-AR-E10881-06Size: 250 UnitsDry Ice: NoHazardous: No

1 / 1

CAT#:1596-AR-E10881-06Size:250 Units

Selected

24/48H Stock Items & 2 to 6 Weeks non Stock Items.

Quick Request Actions

CAS Number

1585-07-5

Molecular Formula

C24H28N2

Molecular Weight

344.50

API Name

Evocalcet

Chemical Information

1-Bromo-4-ethylbenzene

CAS Number	1585-07-5
PubChem CID	15313
IUPAC Name	1-bromo-4-ethylbenzene
Molecular Formula	C8H9Br
Molecular Weight	185.06
XLogP	3.6
Topological Polar Surface Area	0
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	1
Heavy Atom Count	9
Formal Charge	0
Complexity	72

SMILES

CCC1=CC=C(C=C1)Br

InChI

InChI=1S/C8H9Br/c1-2-7-3-5-8(9)6-4-7/h3-6H,2H2,1H3

InChIKey

URFPRAHGGBYNPW-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1585-07-5

CID: 15313

Formula: C8H9Br

MW: 185.06

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	185.06
XLogP3	3.6
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	1
Exact Mass	183.98876
Monoisotopic Mass	183.98876
Topological Polar Surface Area	0 Å²
Heavy Atom Count	9
Formal Charge	0
Complexity	72.6
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