2-Naphthaleneethanol - CAS 1485-07-0

Name: 2-Naphthaleneethanol
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB010310
Product Name:	2-Naphthaleneethanol
CAS:	1485-07-0
Synonyms:	2-naphthalen-2-ylethanol

Technical Data

Safety and Hazards

Patents

Literatures

Computed Properties

IUPAC Name:	2-naphthalen-2-ylethanol
Description:	2-Naphthaleneethanol (CAS# 1485-07-0) is a useful research chemical.
Molecular Weight:	172.22
Molecular Formula:	C12H12O
Canonical SMILES:	C1=CC=C2C=C(C=CC2=C1)CCO
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
Boiling Point:	180-184 °C (15 mmHg)
Density:	1.119 g/cm³
Appearance:	Solid
MDL:	MFCD00004128
LogP:	2.37460

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Related Functional Groups

Oxygen Compounds

[544-62-7]C21H44O3
Batyl alcohol
[1263034-11-2]C38H53N3O2
[(2-Azido-3-hexadecoxypropoxy)-diphenylmethyl]benzene
[1006443-01-1]C9H6N4O4
1-(5-Nitropyridin-2-yl)-1H-pyrazole-3-carboxylic acid
[5333-45-9]C10H14O4
1,2,3,5-Tetramethoxybenzene
[1170836-25-5]C8H11N3O2
1-Cyclopentyl-5-nitro-1H-pyrazole
[202288-73-1]C12H14Cl2N2O
2-(Pyridin-3-ylmethoxy)aniline dihydrochloride

GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Publication Number	Title	Priority Date
CN-111378145-A	Force-induced response multiphase supramolecular block polymer	20190101
WO-2020084131-A1	Aminopeptidase a inhibitors and pharmaceutical compositions comprising the same	20181026
AU-2019365119-B2	Aminopeptidase a inhibitors and pharmaceutical compositions comprising the same	20181026
CN-113166182-A	Aminopeptidase A inhibitor and pharmaceutical composition comprising the same	20181026
EP-3870591-A1	Aminopeptidase a inhibitors and pharmaceutical compositions comprising the same	20181026

PMID	Publication Date	Title	Journal
21931904	20111028	The role of weak hydrogen bonds in chiral recognition	Physical chemistry chemical physics : PCCP
17001413	20061014	Intra- vs. intermolecular hydrogen bonding: dimers of alpha-hydroxyesters with methanol	Physical chemistry chemical physics : PCCP
16482344	20060227	Chiral recognition between lactic acid derivatives and an aromatic alcohol in a supersonic expansion: electronic and vibrational spectroscopy	Physical chemistry chemical physics : PCCP
15200178	20040401	Chemoenzymatic synthesis of optically active, biodegradable polymers based on phenyl- and naphthyl-ethanols esterified with divinyladipate	Biotechnology letters
12123382	20020725	Resolution of 1-(2-naphthyl)ethanol by a combination of an enzyme-catalyzed kinetic resolution with a fluorous triphasic separative reaction	Organic letters

Complexity:	155
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	172.088815002
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	172.088815002
Rotatable Bond Count:	2
Topological Polar Surface Area:	20.2 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3.2