Cas no 103232-23-1 (2-Propenoic acid,3-[(aminoiminomethyl)thio]-, (E)- (9CI))
![2-Propenoic acid,3-[(aminoiminomethyl)thio]-, (E)- (9CI) structure](https://ossimg.kuujia.com/scimg/103500/103232-23-1x500.png)
103232-23-1 structure
Product Name:2-Propenoic acid,3-[(aminoiminomethyl)thio]-, (E)- (9CI)
CAS No:103232-23-1
MF:C4H6N2O2S
MW:146.167639255524
CID:215093
PubChem ID:5282249
Update Time:2025-04-19
2-Propenoic acid,3-[(aminoiminomethyl)thio]-, (E)- (9CI) Chemical and Physical Properties
Names and Identifiers
-
- 2-Propenoic acid,3-[(aminoiminomethyl)thio]-, (E)- (9CI)
- 3-((Aminoiminomethyl)thio)-2-propenoic acid
- NSC 203119
- 2-Propenoic acid, 3-((aminoiminomethyl)thio)-, (Z)-
- 744971-21-9
- SCHEMBL7702852
- 3-Carbamimidoylsulfanylprop-2-enoic acid, (E)-
- 3-[(Aminoiminomethyl)thio]-2-propenoic acid
- 2-Propenoic acid, 3-((aminoiminomethyl)thio)-, (E)-
- NSC203119
- 2-Propenoic acid, 3-[(aminoiminomethyl)thio]-
- AKOS006348857
- (E)-3-(Carbamimidoylthio)acrylic acid
- 3-carbamimidoylsulfanylprop-2-enoic acid
- NSC-203119
- 103232-23-1
- 3-(Carbamimidoylthio)acrylic acid
- G5X9K5PJE2
-
- Inchi： 1S/C4H6N2O2S/c5-4(6)9-2-1-3(7)8/h1-2H,(H3,5,6)(H,7,8)/b2-1+
- InChI Key： QEYNZJBVNYDZKZ-OWOJBTEDSA-N
- SMILES： S(C(=N)N)/C=C/C(=O)O
Computed Properties
- Exact Mass: 146.014999g/mol
- Monoisotopic Mass: 146.014999g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 9
- Rotatable Bond Count: 3
- Complexity: 155
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 1
- Undefined Bond Stereocenter Count: 0
- Molecular Weight: 146.17g/mol
- XLogP3: -0.2
- Topological Polar Surface Area: 113?2
Experimental Properties
- Density: 1.47
- Boiling Point: 314.3°Cat760mmHg
- Flash Point: 143.9°C
- PSA: 112.47000
- LogP: 1.01140
2-Propenoic acid,3-[(aminoiminomethyl)thio]-, (E)- (9CI) Related Literature
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Yang Xu,Min Wang,Donghui Wei,Rongqiang Tian,Zheng Duan,Fran?ois Mathey Dalton Trans., 2019,48, 5523-5526
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Xiang Liu,Qian Sun,A. B. Djuri?i?,Maohai Xie,Baohu Dai,Jinyao Tang,Charles Surya,Changzhong Liao,Kaimin Shih RSC Adv., 2015,5, 100783-100789
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Li-Hua Gan,Rui Wu,Jian-Lei Tian,Patrick W. Fowler Phys. Chem. Chem. Phys., 2017,19, 419-425
-
Huifang Yang,Haoran Guo,Peidong Fan,Xinpan Li,Wenlu Ren,Rui Song Nanoscale, 2020,12, 7024-7034
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