(4-Nitro-benzyl)-phosphonic acid

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Catalog Number

ACM1205625

Product Name

Structure

CAS

1205-62-5

Category

Heterocyclic Organic Compound

Synonyms

(4-Nitro-benzyl)-phosphonic acid

IUPAC Name

(4-nitrophenyl)methylphosphonic acid

Molecular Weight

217.12g/mol

Molecular Formula

C7H8NO5P

Canonical SMILES

C1=CC(=CC=C1CP(=O)(O)O)[N+](=O)[O-]

InChI

InChI=1S/C7H8NO5P/c9-8(10)7-3-1-6(2-4-7)5-14(11,12)13/h1-4H,5H2,(H2,11,12,13)

InChI Key

FZNXRFYRXBFQMX-UHFFFAOYSA-N

Complexity

249

Covalently-Bonded Unit Count

Exact Mass

217.014009g/mol

Formal Charge

H-Bond Acceptor

H-Bond Donor

Heavy Atom Count

Monoisotopic Mass

217.014009g/mol

Rotatable Bond Count

XLogP3

0.1

MSDS

COA

Spec Sheet

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