2-Chloroethyl Propyl Ether

CAT: 0024-sc-485528Size: 25 mLDry Ice: NoHazardous: No

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CAT#:0024-sc-485528Size:25 mL

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CAS Number

42149-74-6

Chemical Information

1-(2-Chloroethoxy)propane

CAS Number	42149-74-6
PubChem CID	123506
IUPAC Name	1-(2-chloroethoxy)propane
Molecular Formula	C5H11ClO
Molecular Weight	122.59
XLogP	1.6
Topological Polar Surface Area	9.2
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	4
Heavy Atom Count	7
Formal Charge	0
Complexity	31

SMILES

CCCOCCCl

InChI

InChI=1S/C5H11ClO/c1-2-4-7-5-3-6/h2-5H2,1H3

InChIKey

BHDSGQOSIWVMJW-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 42149-74-6

CID: 123506

Formula: C5H11ClO

MW: 122.59

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	122.59
XLogP3	1.6
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	4
Exact Mass	122.0498427
Monoisotopic Mass	122.0498427
Topological Polar Surface Area	9.2 Å²
Heavy Atom Count	7
Formal Charge	0
Complexity	31.3
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
sc-487004	2-Chloroethyl Chloromethyl Ether
sc-238000	2-Chloroethyl ether
sc-238000A	2-Chloroethyl ether
sc-238001	2-Chloroethyl ethyl ether
sc-256115	2-Chloroethyl methyl ether
sc-397344	2-Chloroethyl Benzhydryl Ether
sc-238003	2-Chloroethyl vinyl ether
sc-256115A	2-Chloroethyl methyl ether
sc-484662	Benzyl 2-Chloroethyl Ether
sc-232512	4-Bromophenyl 2-chloroethyl ether

Catalog	Name
SBA14974	2-Chloroethyl Propyl Ether
OR322245	2-Aminoethyl n-propyl ether
288279-01	Perfluoro-2- (2-fluorosulfonylethoxy) propyl vinyl ether
PC1008388	Propyl 2,2,3,3-tetrafluoropropyl ether
OR1014748-01	Poly[Bis (2-Chloroethyl) Ether-Alt-1,3-Bis[3- (Dimethylamino) Propyl]Urea] Quaternized
PC450273-01	Propyl 1,1,2,2-tetrafluoroethyl ether
FT100449-01	Tetrafluoroethylene-perfluoro (2- (2-sulfonylethoxy) propyl vinyl ether) copolymer
PC106372	1,1,1,2,2,3,3,4,4,5,5,6,6-Tridecafluorooctane propyl ether
GTR19178207	7'R,8'R-2,2'-Dimethoxy-4- (3-hydroxyl-propenyl) -4'- (1,2,3-trihydroxy-propyl) biphenyl ether
P4061-35	Phenyl 2-Chloroethyl Ether