Cas no 2752-71-8 (Phenol,2-methyl-5-(1-methylethyl)-, 1-(N-methylcarbamate))
2752-71-8 structure
Product Name:Phenol,2-methyl-5-(1-methylethyl)-, 1-(N-methylcarbamate)
CAS No:2752-71-8
MF:C12H17NO2
MW:207.268883466721
CID:264517
PubChem ID:17680
Update Time:2025-04-19
Phenol,2-methyl-5-(1-methylethyl)-, 1-(N-methylcarbamate) Chemical and Physical Properties
Names and Identifiers
-
- Phenol,2-methyl-5-(1-methylethyl)-, 1-(N-methylcarbamate)
- (2-methyl-5-propan-2-ylphenyl) N-methylcarbamate
- BRN 2266072
- Carvacryl methylcarbamate
- 2752-71-8
- 4-06-00-03332 (Beilstein Handbook Reference)
- CARBAMIC ACID, METHYL-, CARVACRYL ESTER
- N-Methylcarbamate of carvacrol
- 2-Methyl-5-(1-methylethyl)phenol 1-(N-methylcarbamate)
- SCHEMBL11798997
- DTXSID20181941
-
- Inchi： 1S/C12H17NO2/c1-8(2)10-6-5-9(3)11(7-10)15-12(14)13-4/h5-8H,1-4H3,(H,13,14)
- InChI Key： IGOIEFUCTIBKFZ-UHFFFAOYSA-N
- SMILES： O(C(NC)=O)C1=C(C)C=CC(=C1)C(C)C
Computed Properties
- Exact Mass: 207.12601
- Monoisotopic Mass: 207.125928785g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 15
- Rotatable Bond Count: 3
- Complexity: 216
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.8
- Topological Polar Surface Area: 38.3?2
Experimental Properties
- PSA: 38.33
Phenol,2-methyl-5-(1-methylethyl)-, 1-(N-methylcarbamate) Related Literature
-
Siquan Zhang,Shengyao Wang,Liping Guo,Hao Chen,Bien Tan,Shangbin Jin J. Mater. Chem. C, 2020,8, 192-200
-
Huifang Yang,Haoran Guo,Peidong Fan,Xinpan Li,Wenlu Ren,Rui Song Nanoscale, 2020,12, 7024-7034
-
Eunhak Lim,Jiyoung Heo,Seong Keun Kim Nanoscale, 2019,11, 11369-11378
-
Hamid Heydari,Mohammad B. Gholivand New J. Chem., 2017,41, 237-244
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