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74440-82-7 | 3-Iodo-5-methoxybenzoic acid
CAS No: 74440-82-7 Catalog No: AG00ICIU MDL No:
Product Description
Catalog Number:
AG00ICIU
Chemical Name:
3-Iodo-5-methoxybenzoic acid
CAS Number:
74440-82-7
IUPAC Name:
3-iodo-5-methoxybenzoic acid
InChI:
InChI=1S/C8H7IO3/c1-12-7-3-5(8(10)11)2-6(9)4-7/h2-4H,1H3,(H,10,11)
InChI Key:
LAGXFKIAZDJQDL-UHFFFAOYSA-N
Properties
Complexity:
172
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
277.944g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
278.045g/mol
Monoisotopic Mass:
277.944g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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