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2-(chloromethyl)-2-[(naphthalen-2-yloxy)methyl]propane-1,3-diol

2-(chloromethyl)-2-[(naphthalen-2-yloxy)methyl]propane-1,3-diol

CAS: 9007-20-9

Formula: C15H17ClO3

SMILES: OCC(CO)(CCl)COC1=CC2=CC=CC=C2C=C1

IUPAC: 2-(chloromethyl)-2-[(naphthalen-2-yloxy)methyl]propane-1,3-diol

InChI: InChI=1S/C15H17ClO3/c16-8-15(9-17,10-18)11-19-14-6-5-12-3-1-2-4-13(12)7-14/h1-7,17-18H,8-11H2

Composition: C (64.17%), H (6.10%), Cl (12.63%), O (17.10%)

Molar Mass: 280.75

Atom Count: 36

Heavy Atom Count: 19

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 280.0866221
Formal Charge 0
FSP3 0.33
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
InChIKey PLZJMCNBPWEGNQ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 75.49
Topological Polar Surface Area 49.69
Polarizability 30.76
Ring Count 2
Rotatable Bond Count 6

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