2-Chloroethyl Carbonochloridate

CAT: 1299-RG-P022719-01Size: 10 mgDry Ice: NoHazardous: No

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CAT#:1299-RG-P022719-01Size:10 mg

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CAS Number

627-11-2

Synonyms

2-chloroethyl carbonochloridate

Molecular Formula

C3H4Cl2O2

Molecular Weight

142.96

Target Alternative Name

Binimetinib

Product Name Synonym

2-chloroethyl carbonochloridate

Chemical Information

2-Chloroethyl chloroformate

Chloroethyl chloroformate is a liquid. (EPA, 1998)

CAS Number	627-11-2
PubChem CID	12305
IUPAC Name	2-chloroethyl carbonochloridate
Molecular Formula	C3H4Cl2O2
Molecular Weight	142.97
XLogP	1.8
Topological Polar Surface Area	26.3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	3
Heavy Atom Count	7
Formal Charge	0
Complexity	64

SMILES

C(CCl)OC(=O)Cl

InChI

InChI=1S/C3H4Cl2O2/c4-1-2-7-3(5)6/h1-2H2

InChIKey

SVDDJQGVOFZBNX-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 627-11-2

CID: 12305

Formula: C3H4Cl2O2

MW: 142.97

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	142.97
XLogP3	1.8
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	3
Exact Mass	141.9588348
Monoisotopic Mass	141.9588348
Topological Polar Surface Area	26.3 Å²
Heavy Atom Count	7
Formal Charge	0
Complexity	64
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
RG-E200882-01	2-Ethylbutyl Carbonochloridate
RG-M082519-01	2-Methylbutyl Carbonochloridate
RG-A261343-01	2-Nitrophenyl Carbonochloridate
RG-E140514-01	2,2-dichloroethyl carbonochloridate
RG-A262854-01	2,2,2-Trichloroethyl Carbonochloridate
RG-A263130-01	2,2,2-Trifluoroethyl Carbonochloridate
RG-T180941-01	Trichloromethyl Carbonochloridate
RG-P181514-01	Propyl Carbonochloridate
RG-A261730-01	4-Nitrophenyl Carbonochloridate
RG-M200843-01	4-Methylpentyl Carbonochloridate

Catalog	Name
418064-01	2-Fluoroethyl Carbonochloridate
OR1053894-01	2-Methylpentyl carbonochloridate
OR1004416	2-Phenoxyethyl carbonochloridate
OR1025199	2-Methoxyethyl Carbonochloridate
OR1046559-01	2-Chlorobenzyl carbonochloridate
OR1050748-01	2-Ethoxyethyl carbonochloridate
OR1047588-01	2-Ethylbutyl carbonochloridate
JH271985	Prop-2-ynyl carbonochloridate
OR1065674-01	2- (Trimethylsilyl) ethyl carbonochloridate
OR1063865-01	Heptan-2-yl carbonochloridate