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4-Phosphonobenzoic Acid

Catalog Number
ACM618213-2
CAS Number
618-21-3
Product Name
4-Phosphonobenzoic Acid
Structure
Category
Self Assembly and Contact Printing Materials
IUPAC Name
4-phosphonobenzoic acid
Molecular Weight
202.1g/mol
Molecular Formula
C7H7O5P
Canonical SMILES
C1=CC(=CC=C1C(=O)O)P(=O)(O)O
InChI
InChI=1S/C7H7O5P/c8-7(9)5-1-3-6(4-2-5)13(10,11)12/h1-4H,(H,8,9)(H2,10,11,12)
InChI Key
IEQICHVXWFGDAN-UHFFFAOYSA-N
Complexity
237
Covalently-Bonded Unit Count
1
Exact Mass
202.00311g/mol
Formal Charge
0
Heavy Atom Count
13
Monoisotopic Mass
202.00311g/mol
NSC Number
13565
Rotatable Bond Count
2
XLogP3
-0.5
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