Structure

Hydrazinecarbothioamide,N-(4-chlorophenyl)-

CAS
22814-92-2
Catalog Number
ACM22814922
Category
Other Products
Molecular Weight
201.68
Molecular Formula
C7H8ClN3S

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  • Case Study
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Specification

Synonyms
Maybridge1_006895, MLS001006790, ALBB-002828, CID706988, ZINC00093921, N-(4-chlorophenyl)hydrazinecarbothioamide, SMR000349689, ST5211203, 22814-92-2
IUPAC Name
1-amino-3-(4-chlorophenyl)thiourea
SMILES
C1=CC(=CC=C1NC(=S)NN)Cl
InChI Key
GFTWJLUVFRTLIL-UHFFFAOYSA-N
Boiling Point
318.3ºC at 760mmHg
Melting Point
179-182ºC
Flash Point
146.3ºC
Density
1.458g/cm³
Exact Mass
201.01300
Hazard Statements
Xi: Irritant;
H-Bond Acceptor
1
H-Bond Donor
3
Packing Group
II
Safety Description
S22-S36/37-S45

Upstream Synthesis Route 1

  • 7392-67-8
  • 22814-92-2

Reference: [1]Busch; Ulmer
[Chemische Berichte, 1902, vol. 35, p. 1718]

Upstream Synthesis Route 2

  • 2131-55-7
  • 22814-92-2

Reference: [1]Khanfar, Mohammad A.; Reiner, David; Hagenow, Stefanie; Stark, Holger
[Bioorganic and Medicinal Chemistry, 2018, vol. 26, # 14, p. 4034 - 4046]

Downstream Synthesis Route 1

  • 98-01-1
  • 22814-92-2
  • 119033-83-9

Reference: [1]Liu, Lu; Xu, Yin-Sui; Chigan, Jia-Zhu; Zhai, Le; Ding, Huan-Huan; Wu, Xiao-Rong; Chen, Wei-Ya; Yang, Ke-Wu
[Bioorganic Chemistry, 2022, vol. 127]
[2]Liu, Lu; Xu, Yin-Sui; Chigan, Jia-Zhu; Zhai, Le; Ding, Huan-Huan; Wu, Xiao-Rong; Chen, Wei-Ya; Yang, Ke-Wu
[Bioorganic Chemistry, 2022, vol. 127]
[3]Perpar; Tisler
[Zeitschrift fur Analytische Chemie, 1957, vol. 155, p. 186,188]

* For details of the synthesis route, please refer to the original source to ensure accuracy.

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