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1551428-44-4 | 2-(propan-2-yl)-4,5,6,7-tetrahydro-2H-indazole-3-carbaldehyde
CAS No: 1551428-44-4 Catalog No: AG01BSN7 MDL No:MFCD30538621
Product Description
Catalog Number:
AG01BSN7
Chemical Name:
2-(propan-2-yl)-4,5,6,7-tetrahydro-2H-indazole-3-carbaldehyde
CAS Number:
1551428-44-4
Molecular Formula:
C11H16N2O
Molecular Weight:
192.2575
MDL Number:
MFCD30538621
IUPAC Name:
2-propan-2-yl-4,5,6,7-tetrahydroindazole-3-carbaldehyde
InChI:
InChI=1S/C11H16N2O/c1-8(2)13-11(7-14)9-5-3-4-6-10(9)12-13/h7-8H,3-6H2,1-2H3
InChI Key:
PLFJXBKNGXGSSF-UHFFFAOYSA-N
SMILES:
O=Cc1c2CCCCc2nn1C(C)C
Properties
Complexity:
217
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.126g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
192.262g/mol
Monoisotopic Mass:
192.126g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
34.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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