p-Toluenesulfonyl semicarbazide supplier

Name
p-Toluenesulfonyl semicarbazide
EINECS 233-857-6
CAS No. 10396-10-8
Article Data11
CAS DataBase
Density 1.381 g/cm³
Solubility
Melting Point 236 °C
Formula C₈H₁₁N₃O₃S
Boiling Point
Molecular Weight 229.26
Flash Point
Transport Information
Appearance white powder
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Benzenesulfonic acid,4-methyl-, 2-(aminocarbonyl)hydrazide;Semicarbazide,1-(p-tolylsulfonyl)- (7CI,8CI);1-(p-Tolylsulfonyl)semicarbazide;1-Tosylsemicarbazide;Blo Foam RA;Celogen RA;Unicell TS;p-Toluenesulfonylsemicarbazide;4-Toluenesulfonyl semicarbazide;
PSA 109.67000
LogP 2.41950

Synthetic route

: 4426-72-6, 51433-48-8
hydrazine carboxamide

: 98-59-9
p-toluenesulfonyl chloride

: 10396-10-8
N4-(4-Toluenesulfonyl)semicarbazide

Conditions

Conditions	Yield
aluminum oxide for 0.25h;	83%
With potassium carbonate In tetrahydrofuran; methanol Acylation;

: 123-77-3
Azodicarboxamid

: 824-79-3
sodium 4-methylbenzenesulfinate

: 10396-10-8
N4-(4-Toluenesulfonyl)semicarbazide

Conditions

Conditions	Yield
In dimethyl sulfoxide

: C9H9Cl3N2O4S

: 10396-10-8
N4-(4-Toluenesulfonyl)semicarbazide

Conditions

Conditions	Yield
With ammonium chloride; N-ethyl-N,N-diisopropylamine In tetrahydrofuran at 20℃; for 0.166667h;

: 2157-16-6
1,4-butanediol bis(chloroformate)

: 10396-10-8
N4-(4-Toluenesulfonyl)semicarbazide

: 60226-44-0
C22H28N6O10S2

Conditions

Conditions	Yield
With potassium hydroxide

: 10396-10-8
N4-(4-Toluenesulfonyl)semicarbazide

: 541-41-3
chloroformic acid ethyl ester

: 60226-46-2
C11H15N3O5S

Conditions

Conditions	Yield
With potassium hydroxide

: 10396-10-8
N4-(4-Toluenesulfonyl)semicarbazide

: 108-23-6
isopropyl chloroformate

: 60226-36-0
1-p-Toluenesulfonyl-1-Carbisopropoxy-2-Carbamyl Hydrazine

Conditions

Conditions	Yield
With potassium hydroxide

: 10396-10-8
N4-(4-Toluenesulfonyl)semicarbazide

: 107-13-1
acrylonitrile

: 16019-18-4
N,N,N'-Tris-(2-cyan-aethyl)-N'-p-toluolsulfonylhydrazin

Conditions

Conditions	Yield
With triethylamine In water

: 10396-10-8
N4-(4-Toluenesulfonyl)semicarbazide

: 79-22-1
methyl chloroformate

: 60226-45-1
C10H13N3O5S

Conditions

Conditions	Yield
With potassium hydroxide

: 10396-10-8
N4-(4-Toluenesulfonyl)semicarbazide

: 592-34-7
carbonochloridic acid, butyl ester

: 60226-47-3
C13H19N3O5S

Conditions

Conditions	Yield
With potassium hydroxide

: 10396-10-8
N4-(4-Toluenesulfonyl)semicarbazide

: 1885-14-9
phenyl chloroformate

: 60226-49-5
C15H15N3O5S

Conditions

Conditions	Yield
With potassium hydroxide

: 10396-10-8
N4-(4-Toluenesulfonyl)semicarbazide

: 543-27-1
isobutyl chloroformate

: 60226-48-4
C13H19N3O5S

Conditions

Conditions	Yield
With potassium hydroxide

: 1336-21-6
ammonium hydroxide

: 10396-10-8
N4-(4-Toluenesulfonyl)semicarbazide

: 108-23-6
isopropyl chloroformate

: 60226-36-0
1-p-Toluenesulfonyl-1-Carbisopropoxy-2-Carbamyl Hydrazine

Conditions

Conditions	Yield
With potassium hydroxide In water

...Expand

p-Toluenesulfonyl semicarbazide Specification

The p-Toluenesulfonyl Semicarbazide is an organic compound with the formula C₈H₁₁N₃O₃S. The systematic name of this chemical is 2-[(4-methylphenyl)sulfonyl]hydrazinecarboxamide. With the CAS registry number 10396-10-8 and EINECS 233-857-6, it is also named as Benzenesulfonic acid, 4-methyl-, 2-(aminocarbonyl)hydrazide. What's more, it is used in foaming of PVC and other plastics and natural synthetic rubber.

The other characteristics of p-Toluenesulfonyl Semicarbazide can be summarized as:
(1)ACD/LogP: 0.18; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.18; (4)ACD/LogD (pH 7.4): 0.13; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 29.91; (8)ACD/KOC (pH 7.4): 26.23; (9)#H bond acceptors: 6; (10)#H bond donors: 4; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 69.31 Å²; (13)Index of Refraction: 1.588; (14)Molar Refractivity: 55.86 cm³; (15)Molar Volume: 165.9 cm³; (16)Polarizability: 22.14×10^-24 cm³; (17)Surface Tension: 55.5 dyne/cm; (18)Density: 1.381 g/cm³.

People can use the following data to convert to the molecule structure.
1. SMILES:O=S(=O)(c1ccc(cc1)C)NNC(=O)N
2. InChI:InChI=1/C8H11N3O3S/c1-6-2-4-7(5-3-6)15(13,14)11-10-8(9)12/h2-5,11H,1H3,(H3,9,10,12)
3. InChIKey:VRFNYSYURHAPFL-UHFFFAOYAQ
4. Std. InChI:InChI=1S/C8H11N3O3S/c1-6-2-4-7(5-3-6)15(13,14)11-10-8(9)12/h2-5,11H,1H3,(H3,9,10,12)
5. Std. InChIKey:VRFNYSYURHAPFL-UHFFFAOYSA-N

Product Name

p-Toluenesulfonyl semicarbazide

Synthetic route

p-Toluenesulfonyl semicarbazide Specification

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