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105675-85-2 | 4-Bromo-1-methyl-1H-pyrazol-5-amine
CAS No: 105675-85-2 Catalog No: AG003KV1 MDL No:MFCD00068157
Product Description
Catalog Number:
AG003KV1
Chemical Name:
4-Bromo-1-methyl-1H-pyrazol-5-amine
CAS Number:
105675-85-2
Molecular Formula:
C4H6BrN3
Molecular Weight:
176.0145
MDL Number:
MFCD00068157
IUPAC Name:
4-bromo-2-methylpyrazol-3-amine
InChI:
InChI=1S/C4H6BrN3/c1-8-4(6)3(5)2-7-8/h2H,6H2,1H3
InChI Key:
ODFDZOQJRPDQDF-UHFFFAOYSA-N
SMILES:
Cn1ncc(c1N)Br
Properties
Complexity:
87.4
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
174.975g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
176.017g/mol
Monoisotopic Mass:
174.975g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
43.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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