(1,1,1,3,3-²H?)pentan-2-ol

(1,1,1,3,3-²H?)pentan-2-ol

CAS: 14629-70-0

Formula: C5H12O

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

IUPAC: (1,1,1,3,3-²H?)pentan-2-ol

InChI: InChI=1/C5H12O/c1-3-4-5(2)6/h5-6H,3-4H2,1-2H3/i2D3,4D2

Composition: C (64.45%), H (7.57%), [2H] (10.81%), O (17.17%)

Molar Mass: 93.181

Atom Count: 18

Heavy Atom Count: 6

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	1
Exact Mass	93.120198736
Formal Charge	0
FSP3	1
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
InChIKey	JYVLIDXNZAXMDK-PVGOWFQYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	26.55
Topological Polar Surface Area	20.23
Polarizability	10.56
Ring Count	0
Rotatable Bond Count	2

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