Cas no 30085-50-8 (Carbamothioic acid,N,N-diethyl-, S-(phenylmethyl) ester)
30085-50-8 structure
Product Name:Carbamothioic acid,N,N-diethyl-, S-(phenylmethyl) ester
CAS No:30085-50-8
MF:C12H17NOS
MW:223.334481954575
CID:308716
PubChem ID:12595890
Update Time:2025-04-19
Carbamothioic acid,N,N-diethyl-, S-(phenylmethyl) ester Chemical and Physical Properties
Names and Identifiers
-
- Carbamothioic acid,N,N-diethyl-, S-(phenylmethyl) ester
- Diethyl-thioca
- AG-E-98514
- Carbamothioic acid, diethyl-, S-(phenylmethyl) ester
- Carbamothioic acid, diethyl-,S-(phenylmethyl) ester (9CI)
- CTK4G4393
- deschlorothi
- S-Benzyl diethylthiocarbamate
- S-Benzyl N,N-diethylthiocarbamate
- S-benzyl N,N-diethylthiolcarbamate
- S-benzyl N,N-diethyltiocarbamate
- (5-OXO-PYRROLIDIN-2-YL)-ACETICACIDMETHYLESTER
- SCHEMBL9099861
- AKOS015962862
- S-benzyl N,N-diethylcarbamothioate
- 30085-50-8
- S-benzyl diethylaminomethanethioate
- DTXSID80184170
- DIETHYL-THIOCARBAMIC ACID S-BENZYL ESTER
-
- Inchi： 1S/C12H17NOS/c1-3-13(4-2)12(14)15-10-11-8-6-5-7-9-11/h5-9H,3-4,10H2,1-2H3
- InChI Key： BKXRWLMGHBHCFY-UHFFFAOYSA-N
- SMILES： S(CC1C=CC=CC=1)C(N(CC)CC)=O
Computed Properties
- Exact Mass: 223.10308534g/mol
- Monoisotopic Mass: 223.10308534g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 15
- Rotatable Bond Count: 5
- Complexity: 186
- 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: 45.6?2
Carbamothioic acid,N,N-diethyl-, S-(phenylmethyl) ester Related Literature
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Guang Xu,Wei Zhang,Ying Zhang,Xiaoxia Zhao,Ping Wen,Di Ma RSC Adv., 2018,8, 19353-19361
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Albertus D. Handoko,Khoong Hong Khoo,Teck Leong Tan,Hongmei Jin,Zhi Wei Seh J. Mater. Chem. A, 2018,6, 21885-21890
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Joo Chuan Yeo,Kenry Lab Chip, 2016,16, 4082-4090
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5. Excimer emission and magnetoluminescence of radical-based zinc(ii) complexes doped in host crystals?Shojiro Kimura,Tetsuro Kusamoto Chem. Commun., 2020,56, 11195-11198
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