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4-Phenanthreneethanol

HCID 263268
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Basic information

CAS
88916-61-4
Standard SMILES
OCCc1cccc2ccc3ccccc3c12
InChIKey
RFAVOBZDPQHPGU-UHFFFAOYSA-N
Molecular formula
C16H14O
Average molar mass
222.28 g/mol
Monoisotopic mass
222.10446507

Names & identifiers

Preferred name
4-Phenanthreneethanol
IUPAC
2-phenanthren-4-ylethanol

Names & synonyms

4-Phenanthreneethanol88916-61-4NSC97652DTXSID70294691NSC-976522-(PHENANTHREN-4-YL)ETHAN-1-OL

Database identifiers

CAS
88916-61-4
PubChem CID
263268
DTXSID
DTXSID70294691

Properties

Computed structural properties

XLogP
4
Topological polar surface area
20.2 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
1
Rotatable bonds
2
Heavy atoms
17
Formal charge
0
Complexity
250

Related reactions

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Compound notes

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