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(²H?)propane-1,2-diol

(²H?)propane-1,2-diol

CAS: 52910-80-2

Formula: C3H8O2

SMILES: [2H]C([2H])([2H])C([2H])(O)C([2H])([2H])O

IUPAC: (²H?)propane-1,2-diol

InChI: InChI=1/C3H8O2/c1-3(5)2-4/h3-5H,2H2,1H3/i1D3,2D2,3D

Composition: C (43.87%), H (2.45%), [2H] (14.71%), O (38.96%)

Molar Mass: 82.132

Atom Count: 13

Heavy Atom Count: 5

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 1
Exact Mass 82.090089973
Formal Charge 0
FSP3 1
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 2
InChIKey DNIAPMSPPWPWGF-LIDOUZCJNA-N
Lipinski's Rule of Five 1
Molar Refractivity 18.97
Topological Polar Surface Area 40.46
Polarizability 7.53
Ring Count 0
Rotatable Bond Count 1

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