Cas no 39668-87-6 (Cyclohexanecarbonyl chloride, 5-methyl-2-(1-methylethyl)- (9CI))
39668-87-6 structure
Product Name:Cyclohexanecarbonyl chloride, 5-methyl-2-(1-methylethyl)- (9CI)
CAS No:39668-87-6
MF:C11H19ClO
MW:202.720962762833
CID:924803
PubChem ID:3084750
Update Time:2025-04-19
Cyclohexanecarbonyl chloride, 5-methyl-2-(1-methylethyl)- (9CI) Chemical and Physical Properties
Names and Identifiers
-
- Cyclohexanecarbonyl chloride, 5-methyl-2-(1-methylethyl)- (9CI)
- 2-isopropyl-5-methylcyclohexanecarbonyl chloride
- 39668-87-6
- Cyclohexanecarbonyl chloride, 5-methyl-2-(1-methylethyl)-, (1R,2S,5R)- (9CI)
- (1R,3R,4S)-p-Menthane-3-carboxylic acid chloride
- (-)-Menthylformyl chloride
- (1R,2S,5R)-5-Methyl-2-(1-methylethyl)cyclohexanecarbonyl chloride; (-)-Menthylformyl chloride; (1R,3R,4S)-p-Menthane-3-carbonyl chloride
- (1R,2S,5R)-5-Methyl-2-(1-methylethyl)cyclohexanecarbonyl chloride
- 108235-80-9
- (1R,2S,5R)-2-isopropyl-5-methylcyclohexane carbonyl chloride
- SCHEMBL2057748
- (1R,2S,5R)-5-methyl-2-(propan-2-yl)cyclohexane-1-carbonyl chloride
- Cyclohexanecarbonyl chloride, 5-methyl-2-(1-methylethyl)-, (1R,2S,5R)-
- (1R,2S,5R)-2-isopropyl-5-methylcyclohexanecarbonyl chloride
- XZZVZSVCQGUKOJ-KXUCPTDWSA-N
- (1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexane-1-carbonyl chloride
-
- Inchi： 1S/C11H19ClO/c1-7(2)9-5-4-8(3)6-10(9)11(12)13/h7-10H,4-6H2,1-3H3/t8-,9+,10-/m1/s1
- InChI Key： XZZVZSVCQGUKOJ-KXUCPTDWSA-N
- SMILES： ClC([C@@H]1C[C@H](C)CC[C@H]1C(C)C)=O
Computed Properties
- Exact Mass: 202.11257
- Monoisotopic Mass: 202.1124429g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 13
- Rotatable Bond Count: 2
- Complexity: 189
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 3
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 4.3
- Topological Polar Surface Area: 17.1?2
Experimental Properties
- PSA: 17.07
Cyclohexanecarbonyl chloride, 5-methyl-2-(1-methylethyl)- (9CI) Related Literature
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J. Matthew Kurley,Phillip W. Halstenberg,Abbey McAlister,Stephen Raiman,Richard T. Mayes RSC Adv., 2019,9, 25602-25608
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
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Amit Kumar Majhi,Subbarao Kanchi,V. Venkataraman,K. G. Ayappa,Prabal K. Maiti Soft Matter, 2015,11, 8632-8640
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