CAS
22150-28-3 Purity
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22150-28-3 Purity
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5-Phenyl-4-thiohydantoic acid
CAS
2215-20-5
Catalog Number
ACM2215205
Category
Other Products
Molecular Weight
210.252900 [g/mol]
Molecular Formula
C9H10N2O2S
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Specification
Synonyms
N-Phenyl-N-carboxymethylthiourea; (3-phenyl-thioureido)acetic acid; 2-[(phenylcarbamothioyl)amino]acetic acid; 5-Phenyl-4-thiohydantoic acid; Glycine,N-(phenylthiocarbamoyl); U 7130; N-phenyl-N-(carboxymethyl)thiocarbamide; N-Phenylthioureidoacetic acid;
IUPAC Name
2-(phenylcarbamothioylamino)acetic acid
SMILES
C1=CC=C(C=C1)NC(=S)NCC(=O)O
InChI Key
UWTLARNSDZXILM-UHFFFAOYSA-N
Boiling Point
379.7ºC at 760mmHg
Flash Point
183.5ºC
Density
1.398g/cm³
EC Number
218-676-2
Exact Mass
210.04600
H-Bond Acceptor
2
H-Bond Donor
3
Downstream Synthesis Route 1
- 2215-20-5
- 2010-15-3
Reference: [1]Wolfe, Derek M.; Schreiner, Peter R.
[Synthesis, 2007, # 13, p. 2002 - 2008]
[2]Location in patent: experimental part
Guzei, Ilia A.; Gunn, Erica M.; Spencer, Lara C.; Schomaker, Jennifer M.; Rigoli, Jared W.
[CrystEngComm, 2011, vol. 13, # 10, p. 3444 - 3450]
[3]Wu, Fangrui; Jiang, Hong; Zheng, Baisong; Kogiso, Mari; Yao, Yuan; Zhou, Chao; Li, Xiao-Nan; Song, Yongcheng
[Journal of Medicinal Chemistry, 2015, vol. 58, # 17, p. 6899 - 6908]
* For details of the synthesis route, please refer to the original source to ensure accuracy.
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