Cas no 30087-47-9 (Phenol, 3,5-diethyl-,1-(N-methylcarbamate))
30087-47-9 structure
Product Name:Phenol, 3,5-diethyl-,1-(N-methylcarbamate)
CAS No:30087-47-9
MF:C12H17NO2
MW:207.268883466721
CID:314378
PubChem ID:34810
Update Time:2025-04-19
Phenol, 3,5-diethyl-,1-(N-methylcarbamate) Chemical and Physical Properties
Names and Identifiers
-
- Phenol, 3,5-diethyl-,1-(N-methylcarbamate)
- NS00122082
- DTXSID6041971
- 3,5-diethylphenyl methylcarbamate
- Phenol, 3,5-diethyl-, methylcarbamate
- PHENOL, 3,5-DIETHYL-, 1-(N-METHYLCARBAMATE)
- BAS-235I
- BAMIC ACID, METHYL-, 3,5-DIETHYLPHENYL ESTER
- Fenethacarb [ISO]
- 4HFM9Z3YRM
- Fenethacarb
- (3,5-diethylphenyl)n-methylcarbamate
- 30087-47-9
- Phenetacarbe
- BRN 1956748
- Q27259596
- (3,5-diethylphenyl) N-methylcarbamate
- 3,5-Diethylphenyl-N-methylcarbamate
- SCHEMBL118111
- UNII-4HFM9Z3YRM
- BAS 235I
- 60181-82-0
- BAS-2353
- 3,5-DIETHYLPHENYL N-METHYLCARBAMATE
- CARBAMIC ACID, METHYL-, 3,5-DIETHYLPHENYL ESTER
- AI3-27984
-
- Inchi： 1S/C12H17NO2/c1-4-9-6-10(5-2)8-11(7-9)15-12(14)13-3/h6-8H,4-5H2,1-3H3,(H,13,14)
- InChI Key： HUNDISMVCBSIKO-UHFFFAOYSA-N
- SMILES： O(C(NC)=O)C1C=C(CC)C=C(C=1)CC
Computed Properties
- Exact Mass: 207.125928785g/mol
- 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: 4
- Complexity: 194
- 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: 3.1
- Topological Polar Surface Area: 38.3?2
Phenol, 3,5-diethyl-,1-(N-methylcarbamate) Related Literature
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Guang Xu,Wei Zhang,Ying Zhang,Xiaoxia Zhao,Ping Wen,Di Ma RSC Adv., 2018,8, 19353-19361
-
Brindha J.,Balamurali M. M.,Kaushik Chanda RSC Adv., 2019,9, 34720-34734
-
Matthew J. Gaunt,Jinquan Yu,Jonathan B. Spencer Chem. Commun., 2001, 1844-1845
-
A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
-
Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
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