Home Amines 1006333-08-9
1006333-08-9,MFCD08558974
Catalog No.:AA0002FM
1006333-08-9 | 1-(2,2-Difluoroethyl)-1H-pyrazol-4-amine hydrochloride
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Technical Information
Catalog Number:
AA0002FM
Chemical Name:
1-(2,2-Difluoroethyl)-1H-pyrazol-4-amine hydrochloride
CAS Number:
1006333-08-9
Molecular Formula:
C5H7F2N3
Molecular Weight:
147.1260
MDL Number:
MFCD08558974
IUPAC Name:
1-(2,2-difluoroethyl)pyrazol-4-amine
InChI:
InChI=1S/C5H7F2N3/c6-5(7)3-10-2-4(8)1-9-10/h1-2,5H,3,8H2
InChI Key:
LMAYRTOWGOVCOR-UHFFFAOYSA-N
SMILES:
FC(Cn1ncc(c1)N)F
Properties
Computed Properties
 
Complexity:
109  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
147.061g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
147.129g/mol
Monoisotopic Mass:
147.061g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
43.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3  

Synonyms
 
1006333-08-9 
1-(2,2-difluoroethyl)-1H-pyrazol-4-amine 
SBB025659 
STK352600 
ZINC12397692 
AKOS000313850 
MCULE-9222261279 
NE36138 
BS-13183 
ST45123180 
T3675 
1-(2,2-Difluoroethyl)-4-amino-1H-pyrazole 
1-(2,2-difluoroethyl)pyrazol-4-amine 
1H-Pyrazol-4-amine,1-(2,2-difluoroethyl)- 
EN300-79410 
1-(2,2-Difluoro-ethyl)-1H-pyrazol-4-ylamine 
1H-Pyrazol-4-amine, 1-(2,2-difluoroethyl)- 
A1-03682 
Z1269702460 
1H-pyrazol-4-amine, 1-(2,2-difluoroethyl)-, hydrochloride 
1-(2,2-difluoroethyl)-1H-pyrazol-4-amine hydrochloride 
1197231-23-4 
1-(2,2-Difluoroethyl)-1H-pyrazol-4-ylamine 
1-(2,2-difluoroethyl)pyrazole-4-ylamine 
SCHEMBL1662503 
CTK7B7176 
LMAYRTOWGOVCOR-UHFFFAOYSA-N 
ALBB-021580 
MFCD08558974 
Literature
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