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202842-95-3 | 1H-Pyrazole-1-methanol, 4-chloro-3-methyl-
CAS No: 202842-95-3 Catalog No: AG0028GU MDL No:
Product Description
Catalog Number:
AG0028GU
Chemical Name:
1H-Pyrazole-1-methanol, 4-chloro-3-methyl-
CAS Number:
202842-95-3
Molecular Formula:
C5H7ClN2O
Molecular Weight:
146.5749
IUPAC Name:
(4-chloro-3-methylpyrazol-1-yl)methanol
InChI:
InChI=1S/C5H7ClN2O/c1-4-5(6)2-8(3-9)7-4/h2,9H,3H2,1H3
InChI Key:
PEXMTQCPTOIQMB-UHFFFAOYSA-N
SMILES:
OCn1cc(c(n1)C)Cl
Properties
Complexity:
101
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
146.025g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
146.574g/mol
Monoisotopic Mass:
146.025g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
38A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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