Cas no 109858-55-1 (Thiourea,N-[(dimethylamino)methyl]-)
![Thiourea,N-[(dimethylamino)methyl]- structure](https://ossimg.kuujia.com/scimg/110000/109858-55-1x500.png)
109858-55-1 structure
Product Name:Thiourea,N-[(dimethylamino)methyl]-
CAS No:109858-55-1
MF:C4H11N3S
MW:133.215238809586
CID:128588
PubChem ID:5365231
Update Time:2025-04-18
Thiourea,N-[(dimethylamino)methyl]- Chemical and Physical Properties
Names and Identifiers
-
- Thiourea,N-[(dimethylamino)methyl]-
- Thiourea,[(dimethylamino)methyl]- (9CI)
- (dimethylamino)methylthiourea
- Thiourea, dimethylaminomethyl
- 109858-55-1
- N-[(Dimethylamino)methyl]thiourea #
- Thiourea, [(dimethylamino)methyl]- (9CI)
- DTXSID50418616
- JMDKZMDNCCDJHH-UHFFFAOYSA-N
-
- Inchi： 1S/C4H11N3S/c1-7(2)3-6-4(5)8/h3H2,1-2H3,(H3,5,6,8)
- InChI Key： JMDKZMDNCCDJHH-UHFFFAOYSA-N
- SMILES： S=C(N)NCN(C)C
Computed Properties
- Exact Mass: 133.06753
- Monoisotopic Mass: 133.06736854g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 8
- Rotatable Bond Count: 2
- Complexity: 81.4
- 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: -0.3
- Topological Polar Surface Area: 73.4?2
Experimental Properties
- PSA: 41.29
Thiourea,N-[(dimethylamino)methyl]- Related Literature
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Dongjia Han,Bing Xue,Juan Du,Tomohiro Miyatake,Hitoshi Tamiaki,Xin Xing,Wei Yuan,Yanyan Li Phys. Chem. Chem. Phys., 2016,18, 24252-24260
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Eric Besson,Stéphane Gastaldi,Emily Bloch,Selma Aslan,Hakim Karoui,Olivier Ouari,Micael Hardy Analyst, 2019,144, 4194-4203
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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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5. Estimating and correcting interference fringes in infrared spectra in infrared hyperspectral imagingGhazal Azarfar,Ebrahim Aboualizadeh,Nicholas M. Walter,Simona Ratti,Camilla Olivieri,Alessandra Norici,Michael Nasse,Achim Kohler,Mario Giordano Analyst, 2018,143, 4674-4683
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