(+) -Chloromethyl isomenthyl ether

CAT: 0024-sc-227627Size: 1 gDry Ice: NoHazardous: No

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CAT#:0024-sc-227627Size:1 g

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CAS Number

144177-48-0

Chemical Information

(1R,2S,4R)-2-(Chloromethoxy)-4-methyl-1-(propan-2-yl)cyclohexane

See also: (+)-Chloromethyl isomenthyl ether (annotation moved to).

CAS Number	144177-48-0
PubChem CID	20055627
IUPAC Name	(1R,2S,4R)-2-(chloromethoxy)-4-methyl-1-propan-2-ylcyclohexane
Molecular Formula	C11H21ClO
Molecular Weight	204.73
XLogP	4.2
Topological Polar Surface Area	9.2
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	3
Heavy Atom Count	13
Formal Charge	0
Complexity	147

SMILES

C[C@@H]1CC[C@@H]([C@H](C1)OCCl)C(C)C

InChI

InChI=1S/C11H21ClO/c1-8(2)10-5-4-9(3)6-11(10)13-7-12/h8-11H,4-7H2,1-3H3/t9-,10-,11+/m1/s1

InChIKey

XOPLTFUYFXWFGB-MXWKQRLJSA-N

Chemical Structure

2D Structure

CAS: 144177-48-0

CID: 20055627

Formula: C11H21ClO

MW: 204.73

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	204.73
XLogP3	4.2
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	3
Exact Mass	204.1280930
Monoisotopic Mass	204.1280930
Topological Polar Surface Area	9.2 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	147
Isotope Atom Count	0
Defined Atom Stereocenter Count	3
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-234335	(-) -Chloromethyl menthyl ether
sc-227626	Chloromethyl ethyl ether
sc-252590	Chloromethyl octyl ether
sc-254965	Benzyl chloromethyl ether
sc-223884	(+) -Chloromethyl menthyl ether
sc-486187	Chloromethyl Cyclohexyl Ether
sc-254965A	Benzyl chloromethyl ether
sc-487036	Chloromethyl 2,2,2-Trichloroethyl Ether
sc-238000A	2-Chloroethyl ether

Catalog	Name
FC34422-01	Chloromethyl ethyl ether
S-877	Chloromethyl methyl ether
OR921970	Chloromethyl cyclohexyl ether
004114	Bis (chloromethyl) Ether
TRC-C587878-5G	Chloromethyl Hexafluoroisopropyl Ether
MBS6104000-01	Bis(chloromethyl) Ether
OR47887-01	Benzyl chloromethyl ether
S-880	bis(Chloromethyl) ether - 1ML
TRC-B233705-25G	Benzyl Chloromethyl Ether (90%)
TRC-C369055-500G	Chloromethyl Ethyl Ether 90%