Tulobuterol Impurity 38

CAT: 1299-RM-T120238-01Size: 10 mgDry Ice: NoHazardous: No

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CAT#:1299-RM-T120238-01Size:10 mg

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

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CAS Number

1597775-10-4

Synonyms

1- (2-chlorophenyl) -2-iodoethan-1-ol

Molecular Formula

C8H8ClIO

Molecular Weight

282.51

Target Alternative Name

Tulobuterol

Product Name Synonym

1- (2-chlorophenyl) -2-iodoethan-1-ol

Chemical Information

1-(2-Chlorophenyl)-2-iodoethan-1-ol

CAS Number	1597775-10-4
PubChem CID	114775225
IUPAC Name	1-(2-chlorophenyl)-2-iodoethanol
Molecular Formula	C8H8ClIO
Molecular Weight	282.50
XLogP	2.8
Topological Polar Surface Area	20.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	2
Heavy Atom Count	11
Formal Charge	0
Complexity	121

SMILES

C1=CC=C(C(=C1)C(CI)O)Cl

InChI

InChI=1S/C8H8ClIO/c9-7-4-2-1-3-6(7)8(11)5-10/h1-4,8,11H,5H2

InChIKey

LLEGSKKSNKZUIZ-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1597775-10-4

CID: 114775225

Formula: C8H8ClIO

MW: 282.50

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	282.50
XLogP3	2.8
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	2
Exact Mass	281.93084
Monoisotopic Mass	281.93084
Topological Polar Surface Area	20.2 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	121
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes