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192661-38-4 | 1H-Pyrazole-4-propanol, 1-methyl-
CAS No: 192661-38-4 Catalog No: AG002G6P MDL No:MFCD07440134
Product Description
Catalog Number:
AG002G6P
Chemical Name:
1H-Pyrazole-4-propanol, 1-methyl-
CAS Number:
192661-38-4
Molecular Formula:
C7H12N2O
Molecular Weight:
140.1830
MDL Number:
MFCD07440134
IUPAC Name:
3-(1-methylpyrazol-4-yl)propan-1-ol
InChI:
InChI=1S/C7H12N2O/c1-9-6-7(5-8-9)3-2-4-10/h5-6,10H,2-4H2,1H3
InChI Key:
ZICNHHFTLCVQCR-UHFFFAOYSA-N
SMILES:
OCCCc1cnn(c1)C
Properties
Complexity:
97.6
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
140.095g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
140.186g/mol
Monoisotopic Mass:
140.095g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
38A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
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