Cas no 58710-66-0 (Carbamic acid,[[[2-[(methoxycarbonyl)amino]phenyl]amino]thioxomethyl]-, methyl ester (9CI))
![Carbamic acid,[[[2-[(methoxycarbonyl)amino]phenyl]amino]thioxomethyl]-, methyl ester (9CI) structure](https://ossimg.kuujia.com/scimg/59000/58710-66-0x500.png)
58710-66-0 structure
Product Name:Carbamic acid,[[[2-[(methoxycarbonyl)amino]phenyl]amino]thioxomethyl]-, methyl ester (9CI)
CAS No:58710-66-0
MF:C11H13N3O4S
MW:283.303621053696
CID:367082
PubChem ID:2762544
Update Time:2025-04-19
Carbamic acid,[[[2-[(methoxycarbonyl)amino]phenyl]amino]thioxomethyl]-, methyl ester (9CI) Chemical and Physical Properties
Names and Identifiers
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- Carbamic acid,[[[2-[(methoxycarbonyl)amino]phenyl]amino]thioxomethyl]-, methyl ester (9CI)
- [[[2-[(METHOXYCARBONYL)AMINO]PHENYL]AMINO]THIOXOMETHYL]-CARBAMIC ACID METHYL ESTER
- 2-(Methoxycarbonyl)aminophenylaminothioxomethyl-carbamic acid methyl ester
- Carbamic acid,[[[2-[(methoxycarbonyl)amino]phenyl]amino]thioxomethyl]-,methyl ester
- Methyl-4-(o-methoxycarbonylaminophenyl)-3-thioallophanat
- FT-0605380
- SCHEMBL11677871
- methyl N-[[2-(methoxycarbonylamino)phenyl]carbamothioyl]carbamate
- 58710-66-0
-
- Inchi： 1S/C11H13N3O4S/c1-17-10(15)13-8-6-4-3-5-7(8)12-9(19)14-11(16)18-2/h3-6H,1-2H3,(H,13,15)(H2,12,14,16,19)
- InChI Key： POWCBWCFIQLMQB-UHFFFAOYSA-N
- SMILES： S=C(NC(=O)OC)NC1C=CC=CC=1NC(=O)OC
Computed Properties
- Exact Mass: 283.06300
- Monoisotopic Mass: 283.063
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 19
- Rotatable Bond Count: 4
- Complexity: 351
- 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: 1.8
- Topological Polar Surface Area: 121?2
Experimental Properties
- Density: 1.426
- Boiling Point: °Cat760mmHg
- Flash Point: °C
- Refractive Index: 1.665
- PSA: 120.78000
- LogP: 2.45460
Carbamic acid,[[[2-[(methoxycarbonyl)amino]phenyl]amino]thioxomethyl]-, methyl ester (9CI) Related Literature
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Lei Yang,Yuan Zeng,Haibo Wu,Chunwu Zhou,Lei Tao J. Mater. Chem. B, 2020,8, 1383-1388
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Xixi Li,Nanwei Zhu,Ruohan Li,Qinpu Zhang Anal. Methods, 2020,12, 3376-3381
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Jieun Kim,Han-Saem Park,Tae-Hee Kim,Sung Yeol Kim,Hyun-Kon Song Phys. Chem. Chem. Phys., 2014,16, 5295-5300
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Zhonghua Xiang,Chuanqi Fang,Sanhua Leng,Dapeng Cao J. Mater. Chem. A, 2014,2, 7662-7665
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Hamid Heydari,Mohammad B. Gholivand New J. Chem., 2017,41, 237-244
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