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4671-77-6

4671-77-6 structural image
Product Name: 1,4-BUTANEDIPHOSPHONIC ACID
Formula: C4H12O6P2
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SAFETY INFORMATION

Signal word Danger
Pictogram(s)

Corrosion
Corrosives
GHS05
GHS Hazard Statements H290:Corrosive to Metals
H314:Skin corrosion/irritation
Precautionary Statement Codes P260:Do not breathe dust/fume/gas/mist/vapours/spray.
P301+P330+P331:IF SWALLOWED: Rinse mouth. Do NOT induce vomiting.

COMPUTED DESCRIPTORS

Molecular Weight 218.08 g/mol
XLogP3 -2.7
Hydrogen Bond Donor Count 4
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 5
Exact Mass 218.01091209 g/mol
Monoisotopic Mass 218.01091209 g/mol
Topological Polar Surface Area 115 Ų
Heavy Atom Count 12
Formal Charge 0
Complexity 190
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes