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1338378-32-7 | 3-Ethoxy-4-iodo-5-methyl-1H-pyrazole
CAS No: 1338378-32-7 Catalog No: AG00A0O7 MDL No:
Product Description
Catalog Number:
AG00A0O7
Chemical Name:
3-Ethoxy-4-iodo-5-methyl-1H-pyrazole
CAS Number:
1338378-32-7
IUPAC Name:
3-ethoxy-4-iodo-5-methyl-1H-pyrazole
InChI:
InChI=1S/C6H9IN2O/c1-3-10-6-5(7)4(2)8-9-6/h3H2,1-2H3,(H,8,9)
InChI Key:
BPVOQZGUHQNIQG-UHFFFAOYSA-N
Properties
Complexity:
112
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
251.976g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
252.055g/mol
Monoisotopic Mass:
251.976g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
37.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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