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285138-88-7

285138-88-7 structural image
Product Name: 1,3-PROPANEDIOL-13C3
Formula: C3H8O2
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SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H315:Skin corrosion/irritation

COMPUTED DESCRIPTORS

Molecular Weight 79.073 g/mol
XLogP3 -1
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 2
Exact Mass 79.062494000 g/mol
Monoisotopic Mass 79.062494000 g/mol
Topological Polar Surface Area 40.5 Ų
Heavy Atom Count 5
Formal Charge 0
Complexity 12.4
Isotope Atom Count 3
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