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Home > Aldehydes > 1547869-24-8
1547869-24-8 | 1,3-DIMETHYL-5-[METHYL(PROP-2-YN-1-YL)AMINO]-1H-PYRAZOLE-4-CARBALDEHYDE
CAS No: 1547869-24-8 Catalog No: AG01C8NS MDL No:MFCD24241036
Product Description
Catalog Number:
AG01C8NS
Chemical Name:
1,3-DIMETHYL-5-[METHYL(PROP-2-YN-1-YL)AMINO]-1H-PYRAZOLE-4-CARBALDEHYDE
CAS Number:
1547869-24-8
Molecular Formula:
C10H13N3O
Molecular Weight:
191.2297
MDL Number:
MFCD24241036
IUPAC Name:
1,3-dimethyl-5-[methyl(prop-2-ynyl)amino]pyrazole-4-carbaldehyde
InChI:
InChI=1S/C10H13N3O/c1-5-6-12(3)10-9(7-14)8(2)11-13(10)4/h1,7H,6H2,2-4H3
InChI Key:
CODCLMSMTWJSAB-UHFFFAOYSA-N
SMILES:
CN(c1c(C=O)c(nn1C)C)CC#C
Properties
Complexity:
257
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.106g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
191.234g/mol
Monoisotopic Mass:
191.106g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
38.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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