Cas no 71172-46-8 (Benzenemethanol, a-methyl-a-(1-methylcyclopropyl)-)
71172-46-8 structure
Product Name:Benzenemethanol, a-methyl-a-(1-methylcyclopropyl)-
CAS No:71172-46-8
MF:C12H16O
MW:176.254843711853
CID:566235
PubChem ID:3018080
Update Time:2025-04-19
Benzenemethanol, a-methyl-a-(1-methylcyclopropyl)- Chemical and Physical Properties
Names and Identifiers
-
- Benzenemethanol, a-methyl-a-(1-methylcyclopropyl)-
- 1-(1-Methylcyclopropyl)-1-phenylethanol
- alpha-methyl-alpha-(1-methylcyclopropyl)benzyl alcohol
- Α-METHYL-Α-(1-METHYLCYCLOPROPYL)BENZYL ALCOHOL
- AKOS017515828
- 1-(1-methylcyclopropyl)-1-phenylethan-1-ol
- EINECS 275-232-0
- NS00060483
- 71172-46-8
- DTXSID80991487
-
- Inchi： 1S/C12H16O/c1-11(8-9-11)12(2,13)10-6-4-3-5-7-10/h3-7,13H,8-9H2,1-2H3
- InChI Key： JKVXNQHAQDPGRQ-UHFFFAOYSA-N
- SMILES： OC(C1C=CC=CC=1)(C)C1(C)CC1
Computed Properties
- Exact Mass: 176.12
- Monoisotopic Mass: 176.12
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 13
- Rotatable Bond Count: 2
- Complexity: 189
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Surface Charge: 0
- Tautomer Count: nothing
- XLogP3: 2.4
- Topological Polar Surface Area: 20.2A^2
Experimental Properties
- Density: 1.069
- Boiling Point: 266.2°C at 760 mmHg
- Flash Point: 110.8°C
- Refractive Index: 1.56
Benzenemethanol, a-methyl-a-(1-methylcyclopropyl)- Related Literature
-
Sandip Gangadhar Balwe,Yeon Tae Jeong Org. Biomol. Chem., 2018,16, 1287-1296
71172-46-8 (Benzenemethanol, a-methyl-a-(1-methylcyclopropyl)-) Related Products
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