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1018663-45-0 | 3-Cyclopentapyrazolecarboxaldehyde, 1,4,5,6-tetrahydro-
CAS No: 1018663-45-0 Catalog No: AG0005S9 MDL No:MFCD10036254
Product Description
Catalog Number:
AG0005S9
Chemical Name:
3-Cyclopentapyrazolecarboxaldehyde, 1,4,5,6-tetrahydro-
CAS Number:
1018663-45-0
Molecular Formula:
C7H8N2O
Molecular Weight:
136.1512
MDL Number:
MFCD10036254
IUPAC Name:
1,4,5,6-tetrahydrocyclopenta[c]pyrazole-3-carbaldehyde
InChI:
InChI=1S/C7H8N2O/c10-4-7-5-2-1-3-6(5)8-9-7/h4H,1-3H2,(H,8,9)
InChI Key:
OARNCDPKZBAFOW-UHFFFAOYSA-N
SMILES:
O=Cc1n[nH]c2c1CCC2
Properties
Complexity:
149
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
136.064g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
136.154g/mol
Monoisotopic Mass:
136.064g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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