Cas no 92263-28-0 (1-(3-(Dibutylamino)propyl)-3-phenyl-2-thiourea)
92263-28-0 structure
Product Name:1-(3-(Dibutylamino)propyl)-3-phenyl-2-thiourea
CAS No:92263-28-0
MF:C18H31N3S
MW:321.523843050003
CID:998313
PubChem ID:4085815
Update Time:2025-04-20
1-(3-(Dibutylamino)propyl)-3-phenyl-2-thiourea Chemical and Physical Properties
Names and Identifiers
-
- 1-[3-(dibutylamino)propyl]-3-phenylthiourea
- SCHEMBL5448339
- NSC-204786
- DTXSID30399151
- 1-(3-(dibutylamino)propyl)-3-phenyl-2-thiourea
- 92263-28-0
- ST50556998
- AKOS024340256
- NSC204786
- 1-(3-(Dibutylamino)propyl)-3-phenyl-2-thiourea
-
- Inchi： 1S/C18H31N3S/c1-3-5-14-21(15-6-4-2)16-10-13-19-18(22)20-17-11-8-7-9-12-17/h7-9,11-12H,3-6,10,13-16H2,1-2H3,(H2,19,20,22)
- InChI Key： IYINLXVXEWSLLF-UHFFFAOYSA-N
- SMILES： S=C(NC1C=CC=CC=1)NCCCN(CCCC)CCCC
Computed Properties
- Exact Mass: 321.224
- Monoisotopic Mass: 321.224
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 22
- Rotatable Bond Count: 11
- Complexity: 270
- 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: 3.9
- Topological Polar Surface Area: 59.4?2
Experimental Properties
- Density: 1.032
- Boiling Point: 422.2°C at 760 mmHg
- Flash Point: 209.1°C
- Refractive Index: 1.564
- PSA: 59.39000
- LogP: 4.72920
1-(3-(Dibutylamino)propyl)-3-phenyl-2-thiourea Related Literature
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
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Bin Han,Yasuo Shimizu,Gabriele Seguini,Celia Castro,Gérard Ben Assayag,Koji Inoue,Yasuyoshi Nagai,Sylvie Schamm-Chardon,Michele Perego RSC Adv., 2016,6, 3617-3622
-
Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
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Qiao Song,Angela Bamesberger,Lingyun Yang,Haley Houtwed,Haishi Cao Analyst, 2014,139, 3588-3592
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