CAS 7228-47-9 | 1-(Naphthalen-2-yl)ethanol | CAS Number 7228-47-9

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7228-47-9 | 1-(Naphthalen-2-yl)ethanol

CAS No: 7228-47-9 Catalog No: AG003D3Q MDL No:MFCD00004111

Product Description

Catalog Number:

AG003D3Q

Chemical Name:

1-(Naphthalen-2-yl)ethanol

CAS Number:

7228-47-9

Molecular Formula:

C12H12O

Molecular Weight:

172.2231

MDL Number:

MFCD00004111

IUPAC Name:

1-naphthalen-2-ylethanol

InChI:

InChI=1S/C12H12O/c1-9(13)11-7-6-10-4-2-3-5-12(10)8-11/h2-9,13H,1H3

InChI Key:

AXRKCRWZRKETCK-UHFFFAOYSA-N

SMILES:

CC(c1ccc2c(c1)cccc2)O

EC Number:

230-630-3

NSC Number:

92277

Properties

Complexity:

167

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:

Literature

Title	Journal
The role of weak hydrogen bonds in chiral recognition.	Physical chemistry chemical physics : PCCP 20111028
Triethyl-ammonium (S)-(-)-O-[1-(2-naphth-yl)eth-yl] (4-meth-oxy-phen-yl)dithio-phospho-nate.	Acta crystallographica. Section E, Structure reports online 20110501
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.	Bioorganic & medicinal chemistry letters 20101101
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