(4-Methoxybenzyl)phosphonic acid

• CAS: 40299-61-4
• Catalog Number: ACM40299614
• Category: Biomaterials
• Molecular Weight: 202.14g/mol
• Molecular Formula: C8H11O4P
• Synonyms: (4-METHOXYBENZYL)PHOSPHONIC ACID;(4-Methoxybenzyl)phosphonic acid, 98 %
• IUPAC Name: (4-methoxyphenyl)methylphosphonic acid
• SMILES: COC1=CC=C(C=C1)CP(=O)(O)O
• InChI: InChI=1S/C8H11O4P/c1-12-8-4-2-7(3-5-8)6-13(9,10)11/h2-5H,6H2,1H3,(H2,9,10,11)
• InChI Key: XUAVFSMXCWTYNM-UHFFFAOYSA-N
• Complexity: 192
• Covalently-Bonded Unit Count: 1
• Exact Mass: 202.039496g/mol
• Formal Charge: 0
• H-Bond Acceptor: 4
• H-Bond Donor: 2
• Heavy Atom Count: 13
• Monoisotopic Mass: 202.039496g/mol
• Rotatable Bond Count: 3
• XLogP3: 0

Custom Q&A

What is the molecular formula of (4-Methoxybenzyl)phosphonic acid?

The molecular formula is C8H11O4P.

What is the molecular weight of (4-Methoxybenzyl)phosphonic acid?

The molecular weight is 202.14 g/mol.

What is the IUPAC name of (4-Methoxybenzyl)phosphonic acid?

The IUPAC name is (4-methoxyphenyl)methylphosphonic acid.

What is the InChI of (4-Methoxybenzyl)phosphonic acid?

The InChI is InChI=1S/C8H11O4P/c1-12-8-4-2-7(3-5-8)6-13(9,10)11/h2-5H,6H2,1H3,(H2,9,10,11).

What is the InChIKey of (4-Methoxybenzyl)phosphonic acid?

The InChIKey is XUAVFSMXCWTYNM-UHFFFAOYSA-N.

What is the canonical SMILES of (4-Methoxybenzyl)phosphonic acid?

The canonical SMILES is COC1=CC=C(C=C1)CP(=O)(O)O.

What is the CAS number of (4-Methoxybenzyl)phosphonic acid?

The CAS number is 40299-61-4.

What is the European Community (EC) number of (4-Methoxybenzyl)phosphonic acid?

The EC number is 809-291-6.

What is the molecular weight of (4-Methoxybenzyl)phosphonic acid according to PubChem?

The molecular weight is 202.14 g/mol.

Is (4-Methoxybenzyl)phosphonic acid a canonicalized compound according to PubChem?

Yes, it is a canonicalized compound according to PubChem.