2-Chloroethyl methyl ether

CAT: 0127-OR17824-01Size: 25 gDry Ice: NoHazardous: No

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CAT#:0127-OR17824-01Size:25 g

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CAS Number

627-42-9

Synonyms

1-Chloro-2-methoxyethane, 1-Chloro-3-oxabutane

MDL Number

MFCD00000972

Purity

=95%

Smiles

COCCCl

Chemical Information

2-Chloroethyl methyl ether

CAS Number	627-42-9
PubChem CID	12316
IUPAC Name	1-chloro-2-methoxyethane
Molecular Formula	C3H7ClO
Molecular Weight	94.54
XLogP	0.7
Topological Polar Surface Area	9.2
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	2
Heavy Atom Count	5
Formal Charge	0
Complexity	16

SMILES

COCCCl

InChI

InChI=1S/C3H7ClO/c1-5-3-2-4/h2-3H2,1H3

InChIKey

XTIGGAHUZJWQMD-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 627-42-9

CID: 12316

Formula: C3H7ClO

MW: 94.54

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	94.54
XLogP3	0.7
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	2
Exact Mass	94.0185425
Monoisotopic Mass	94.0185425
Topological Polar Surface Area	9.2 Å²
Heavy Atom Count	5
Formal Charge	0
Complexity	16.4
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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