4-chloro-3-fluoro-2-iodophenol

CAT: 0127-PC1015645-01Size: 250 mgDry Ice: NoHazardous: No

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CAT#:0127-PC1015645-01Size:250 mg

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

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CAS Number

2351937-31-8

MDL Number

MFCD31725567

Purity

97%

Smiles

C1 (c (ccc (c1I) O) Cl) F

Chemical Information

4-Chloro-3-fluoro-2-iodophenol

CAS Number	2351937-31-8
PubChem CID	162682257
IUPAC Name	4-chloro-3-fluoro-2-iodophenol
Molecular Formula	C6H3ClFIO
Molecular Weight	272.44
XLogP	2.9
Topological Polar Surface Area	20.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Heavy Atom Count	10
Formal Charge	0
Complexity	124

SMILES

C1=CC(=C(C(=C1O)I)F)Cl

InChI

InChI=1S/C6H3ClFIO/c7-3-1-2-4(10)6(9)5(3)8/h1-2,10H

InChIKey

UWGHEUMXDQGWBD-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 2351937-31-8

CID: 162682257

Formula: C6H3ClFIO

MW: 272.44

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	272.44
XLogP3	2.9
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Exact Mass	271.89012
Monoisotopic Mass	271.89012
Topological Polar Surface Area	20.2 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	124
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