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3-(Naphthalen-1-yloxy)propan-1-ol

HCID 254516
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Basic information

CAS
54804-70-5
Standard SMILES
OCCCOc1cccc2ccccc12
InChIKey
VYNCQICJXQWJRR-UHFFFAOYSA-N
Molecular formula
C13H14O2
Average molar mass
202.25 g/mol
Monoisotopic mass
202.09937969

Names & identifiers

Preferred name
3-(Naphthalen-1-yloxy)propan-1-ol
IUPAC
3-naphthalen-1-yloxypropan-1-ol

Names & synonyms

3-(naphthalen-1-yloxy)propan-1-ol54804-70-51-Propanol, 3-(1-naphthyloxy)-3-naphthalen-1-yloxypropan-1-ol1-Propanol, 3-(1-naphthalenyloxy)-NSC78915NCIOpen2_004219SCHEMBL3607494SCHEMBL3607496DTXSID90291884ECA80470NSC-78915
Show more names
AKOS008131956CCG-2957943-[(Naphthalen-1-yl)oxy]propan-1-olDS-003175CS-0253654EN300-64798G26090Z425795926

Database identifiers

CAS
54804-70-5
PubChem CID
254516
DTXSID
DTXSID90291884
Nikkaji
J2.757.867E

Properties

Computed structural properties

XLogP
3.3
Topological polar surface area
29.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
4
Heavy atoms
15
Formal charge
0
Complexity
181

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