Cas no 62351-13-7 (Thiourea, N-(1-methylpropyl)-N'-propyl-)
62351-13-7 structure
Product Name:Thiourea, N-(1-methylpropyl)-N'-propyl-
CAS No:62351-13-7
MF:C8H18N2S
MW:174.306920528412
CID:448322
PubChem ID:19652061
Update Time:2025-04-19
Thiourea, N-(1-methylpropyl)-N'-propyl- Chemical and Physical Properties
Names and Identifiers
-
- Thiourea, N-(1-methylpropyl)-N'-propyl-
- 1-butan-2-yl-3-propylthiourea
- AKOS003716386
- DTXSID80599169
- N-Butan-2-yl-N'-propylthiourea
- 62351-13-7
-
- Inchi: 1S/C8H18N2S/c1-4-6-9-8(11)10-7(3)5-2/h7H,4-6H2,1-3H3,(H2,9,10,11)
- InChI Key: ZOQJLQHKGGSORN-UHFFFAOYSA-N
- SMILES: S=C(NCCC)NC(C)CC
Computed Properties
- Exact Mass: 174.11924
- Monoisotopic Mass: 174.11906976g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 11
- Rotatable Bond Count: 4
- Complexity: 115
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.2
- Topological Polar Surface Area: 56.2?2
Experimental Properties
- PSA: 24.06
Thiourea, N-(1-methylpropyl)-N'-propyl- Related Literature
-
Qiao Song,Angela Bamesberger,Lingyun Yang,Haley Houtwed,Haishi Cao Analyst, 2014,139, 3588-3592
-
David White,Sean R. Stowell Biomater. Sci., 2017,5, 463-474
-
Joo Chuan Yeo,Kenry Lab Chip, 2016,16, 4082-4090
-
Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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