CAS 1485-07-0 | 2-Naphthaleneethanol | CAS Number 1485-07-0

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1485-07-0 | 2-Naphthaleneethanol

CAS No: 1485-07-0 Catalog No: AG001KYT MDL No:MFCD00004128

Product Description

Catalog Number:

AG001KYT

Chemical Name:

2-Naphthaleneethanol

CAS Number:

1485-07-0

Molecular Formula:

C12H12O

Molecular Weight:

172.2231

MDL Number:

MFCD00004128

IUPAC Name:

2-naphthalen-2-ylethanol

InChI:

InChI=1S/C12H12O/c13-8-7-10-5-6-11-3-1-2-4-12(11)9-10/h1-6,9,13H,7-8H2

InChI Key:

VCZANYLMPFRUHG-UHFFFAOYSA-N

SMILES:

OCCc1ccc2c(c1)cccc2

EC Number:

216-061-3

NSC Number:

21040

Properties

Complexity:

155

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

172.089g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

172.227g/mol

Monoisotopic Mass:

172.089g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

20.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.2

Literature

Title	Journal
The role of weak hydrogen bonds in chiral recognition.	Physical chemistry chemical physics : PCCP 20111028
Intra- vs. intermolecular hydrogen bonding: dimers of alpha-hydroxyesters with methanol.	Physical chemistry chemical physics : PCCP 20061014
Chiral recognition between lactic acid derivatives and an aromatic alcohol in a supersonic expansion: electronic and vibrational spectroscopy.	Physical chemistry chemical physics : PCCP 20060227
Chemoenzymatic synthesis of optically active, biodegradable polymers based on phenyl- and naphthyl-ethanols esterified with divinyladipate.	Biotechnology letters 20040401
Resolution of 1-(2-naphthyl)ethanol by a combination of an enzyme-catalyzed kinetic resolution with a fluorous triphasic separative reaction.	Organic letters 20020725