Oxalyl chloride

CAT: 0063-30419589-100gSize: 100 gDry Ice: NoHazardous: No

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CAT#:0063-30419589-100gSize:100 g

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CAS Number

79-37-8

Molecular Formula

ClCOCOCl

Molecular Weight

126.93

Chemical Information

Oxalyl chloride

CAS Number	79-37-8
PubChem CID	65578
IUPAC Name	oxalyl dichloride
Molecular Formula	C2Cl2O2
Molecular Weight	126.92
XLogP	1.7
Topological Polar Surface Area	34.1
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Heavy Atom Count	6
Formal Charge	0
Complexity	75

SMILES

C(=O)(C(=O)Cl)Cl

InChI

InChI=1S/C2Cl2O2/c3-1(5)2(4)6

InChIKey

CTSLXHKWHWQRSH-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 79-37-8

CID: 65578

Formula: C2Cl2O2

MW: 126.92

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	126.92
XLogP3	1.7
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	125.9275346
Monoisotopic Mass	125.9275346
Topological Polar Surface Area	34.1 Å²
Heavy Atom Count	6
Formal Charge	0
Complexity	75.5
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

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Catalog	Name
TRC-O845020-250G	Oxalyl Chloride
286206-01	Oxalyl chloride discontinued
OR924197-01	Methyl oxalyl chloride
O03780-01	Oxalyl chloride 98%
FO172947-01	Oxalyl chloride, 2M in Dichloromethane
E13430-01	Ethyl oxalyl chloride 99%
029426-01	Oxalyl Chloride for Synthesis 98.0%
1905B 00500	Oxalyl Chloride 97.5% For Synthesis
AR-F09638-01	Faropenem Impurity 23 (Oxalyl Chloride)
241115-01	Oxalyl chloride 99+% (GC) discontinued. See 165758