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85302-16-5 | 1-Methyl-6,7-dihydro-1H-indazol-4(5H)-one
CAS No: 85302-16-5 Catalog No: AG004LPB MDL No:MFCD00930489
Product Description
Catalog Number:
AG004LPB
Chemical Name:
1-Methyl-6,7-dihydro-1H-indazol-4(5H)-one
CAS Number:
85302-16-5
Molecular Formula:
C8H10N2O
Molecular Weight:
150.1778
MDL Number:
MFCD00930489
IUPAC Name:
1-methyl-6,7-dihydro-5H-indazol-4-one
InChI:
InChI=1S/C8H10N2O/c1-10-7-3-2-4-8(11)6(7)5-9-10/h5H,2-4H2,1H3
InChI Key:
PWZFWKUHDMFIAL-UHFFFAOYSA-N
SMILES:
O=C1CCCc2c1cnn2C
Properties
Complexity:
181
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
150.079g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
150.181g/mol
Monoisotopic Mass:
150.079g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
34.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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