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Home > Aldehydes > 2090224-36-3
2090224-36-3 | 4-(3-methyl-1H-pyrazol-4-yl)thiophene-2-carbaldehyde
CAS No: 2090224-36-3 Catalog No: AG01CA2W MDL No:
Product Description
Catalog Number:
AG01CA2W
Chemical Name:
4-(3-methyl-1H-pyrazol-4-yl)thiophene-2-carbaldehyde
CAS Number:
2090224-36-3
Molecular Formula:
C9H8N2OS
Molecular Weight:
192.2376
IUPAC Name:
4-(5-methyl-1H-pyrazol-4-yl)thiophene-2-carbaldehyde
InChI:
InChI=1S/C9H8N2OS/c1-6-9(3-10-11-6)7-2-8(4-12)13-5-7/h2-5H,1H3,(H,10,11)
InChI Key:
FRJAWGLWYRJNBB-UHFFFAOYSA-N
SMILES:
O=Cc1scc(c1)c1c[nH]nc1C
Properties
Complexity:
200
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.036g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
192.236g/mol
Monoisotopic Mass:
192.036g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
74A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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