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1000896-40-1,MFCD18205693
Catalog No.:AA0000T1
1000896-40-1 | 1H-Pyrazol-3-amine, 5-(phenylmethoxy)-
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500mg
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$293.00
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Technical Information
Catalog Number:
AA0000T1
Chemical Name:
1H-Pyrazol-3-amine, 5-(phenylmethoxy)-
CAS Number:
1000896-40-1
Molecular Formula:
C10H11N3O
Molecular Weight:
189.2138
MDL Number:
MFCD18205693
IUPAC Name:
3-phenylmethoxy-1H-pyrazol-5-amine
InChI:
InChI=1S/C10H11N3O/c11-9-6-10(13-12-9)14-7-8-4-2-1-3-5-8/h1-6H,7H2,(H3,11,12,13)
InChI Key:
DPMPAHAAODHNKV-UHFFFAOYSA-N
SMILES:
Nc1n[nH]c(c1)OCc1ccccc1
Properties
Computed Properties
 
Complexity:
171  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.09g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
189.218g/mol
Monoisotopic Mass:
189.09g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
63.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  

Synonyms
 
5-(benzyloxy)-1H-pyrazol-3-amine 
1000896-40-1 
MFCD18205693 
ZINC72319673 
AKOS016000437 
ACN-001441 
DS-5401 
FCH1152122 
1H-Pyrazol-3-amine, 5-(phenylmethoxy)- 
AX8244204 
FT-0686196 
X5092 
3-phenylmethoxy-1H-pyrazol-5-amine 
C10H11N3O 
AK118788 
5-phenylmethoxy-2h-pyrazol-3-amine 
SCHEMBL3937691 
KS-00000QZR 
DTXSID70569836 
QC-92 
3-(Benzyloxy)-1H-pyrazol-5-amine 
Literature
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