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25458-44-0 | 4-(Methoxymethoxy)benzoic acid
CAS No: 25458-44-0 Catalog No: AG003K8W MDL No:MFCD21101751
Product Description
Catalog Number:
AG003K8W
Chemical Name:
4-(Methoxymethoxy)benzoic acid
CAS Number:
25458-44-0
Molecular Formula:
C9H10O4
Molecular Weight:
182.1733
MDL Number:
MFCD21101751
IUPAC Name:
4-(methoxymethoxy)benzoic acid
InChI:
InChI=1S/C9H10O4/c1-12-6-13-8-4-2-7(3-5-8)9(10)11/h2-5H,6H2,1H3,(H,10,11)
InChI Key:
XIFRBTZCMICRPL-UHFFFAOYSA-N
SMILES:
COCOc1ccc(cc1)C(=O)O
Properties
Complexity:
161
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.058g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
182.175g/mol
Monoisotopic Mass:
182.058g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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