3-Methoxybenzylphosphonic acid - CAS 1263034-19-0
Catalog: |
BB043064 |
Product Name: |
3-Methoxybenzylphosphonic acid |
CAS: |
1263034-19-0 |
Synonyms: |
SCHEMBL5672502; Phosphonic acid, P-[(3-methoxyphenyl)methyl]- |
IUPAC Name: | (3-methoxyphenyl)methylphosphonic acid |
Description: | 3-Methoxybenzylphosphonic acid (CAS# 1263034-19-0 ) is a useful research chemical. |
Molecular Weight: | 202.14 |
Molecular Formula: | C8H11O4P |
Canonical SMILES: | COC1=CC=CC(=C1)CP(=O)(O)O |
InChI: | InChI=1S/C8H11O4P/c1-12-8-4-2-3-7(5-8)6-13(9,10)11/h2-5H,6H2,1H3,(H2,9,10,11) |
InChI Key: | JZSAHUBCZHLLJF-UHFFFAOYSA-N |
Complexity: | 200 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 202.03949583 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 202.03949583 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 66.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0 |
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