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81329-97-7 | Benzenemethanol, 4-(2-iodoethoxy)-3-methoxy-
CAS No: 81329-97-7 Catalog No: AG00533V MDL No:
Product Description
Catalog Number:
AG00533V
Chemical Name:
Benzenemethanol, 4-(2-iodoethoxy)-3-methoxy-
CAS Number:
81329-97-7
Molecular Formula:
C10H13IO3
Molecular Weight:
308.1129
IUPAC Name:
[4-(2-iodoethoxy)-3-methoxyphenyl]methanol
InChI:
InChI=1S/C10H13IO3/c1-13-10-6-8(7-12)2-3-9(10)14-5-4-11/h2-3,6,12H,4-5,7H2,1H3
InChI Key:
HWNQVNRYZAJHSM-UHFFFAOYSA-N
SMILES:
ICCOc1ccc(cc1OC)CO
Properties
Complexity:
154
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
307.991g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
308.115g/mol
Monoisotopic Mass:
307.991g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
38.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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