Cas no 17124-82-2 (Carbamimidothioic acid,2-(dimethylamino)ethyl ester)
17124-82-2 structure
Product Name:Carbamimidothioic acid,2-(dimethylamino)ethyl ester
CAS No:17124-82-2
MF:C5H13N3S
MW:147.241819143295
CID:173400
PubChem ID:85296
Update Time:2025-04-19
Carbamimidothioic acid,2-(dimethylamino)ethyl ester Chemical and Physical Properties
Names and Identifiers
-
- Carbamimidothioic acid,2-(dimethylamino)ethyl ester
- nordimaprit
- 2-(S-Dimethylaminoethyl)isothiourea
- SK&F 91487
- Skf-91487
- DTXSID40864663
- 2-(Dimethylaminoethyl) iminoaminomethyl sulfide
- Carbamimidothioic acid, 2-(dimethylamino)ethyl ester
- starbld0005051
- 17124-82-2
- 2-(Dimethylamino)ethyl imidothiocarbamate #
- 2-(dimethylamino)ethyl carbamimidothioate
- AKOS006221645
- MUYRPUKYVOXLSN-UHFFFAOYSA-N
- SCHEMBL7216548
-
- Inchi: 1S/C5H13N3S/c1-8(2)3-4-9-5(6)7/h3-4H2,1-2H3,(H3,6,7)
- InChI Key: MUYRPUKYVOXLSN-UHFFFAOYSA-N
- SMILES: S(C(=N)N)CCN(C)C
Computed Properties
- Exact Mass: 147.08319
- Monoisotopic Mass: 147.08301860g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 9
- Rotatable Bond Count: 4
- Complexity: 92.2
- 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: 0.2
- Topological Polar Surface Area: 78.4?2
Experimental Properties
- PSA: 53.11
Carbamimidothioic acid,2-(dimethylamino)ethyl ester Related Literature
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1. 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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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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Peiyuan Zeng,Xiaoxiao Wang,Ming Ye,Qiuyang Ma,Jianwen Li,Wanwan Wang,Baoyou Geng,Zhen Fang RSC Adv., 2016,6, 23074-23084
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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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Amandine Altmayer-Henzien,Valérie Declerck,David J. Aitken,Ewen Lescop,Denis Merlet,Jonathan Farjon Org. Biomol. Chem., 2013,11, 7611-7615
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