2-Chloro-4-fluorobenzyl Alcohol - CAS 208186-84-9

Catalog:	BB016327
Product Name:	2-Chloro-4-fluorobenzyl Alcohol
CAS:	208186-84-9
Synonyms:	(2-chloro-4-fluorophenyl)methanol; (2-chloro-4-fluorophenyl)methanol

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Computed Properties

IUPAC Name:	(2-chloro-4-fluorophenyl)methanol
Description:	2-Chloro-4-fluorobenzyl Alcohol (CAS# 208186-84-9) is a useful research chemical.
Molecular Weight:	160.57
Molecular Formula:	C7H6ClFO
Canonical SMILES:	C1=CC(=C(C=C1F)Cl)CO
InChI:	InChI=1S/C7H6ClFO/c8-7-3-6(9)2-1-5(7)4-10/h1-3,10H,4H2
InChI Key:	ZUHMDLLAHZUDRE-UHFFFAOYSA-N
Boiling Point:	233.1 °C at 760 mmHg
Density:	1.344 g/cm³
MDL:	MFCD00236024
LogP:	1.97140

Publication Number	Title	Priority Date
CN-112079703-A	Preparation method of 2-chloro-4-fluoro-benzaldehyde	20200901
WO-2020245136-A1	Purine derivatives, as nr2b negative modulators and the use thereof as medicament, in particular for treating depressive disorders	20190604
CN-111848406-A	Preparation method of 2-chloro-4-fluoro-5-nitrobenzaldehyde	20190426
WO-2019214399-A1	Benzo- seven-membered heterocyclic compound, preparation method therefor, pharmaceutical composition thereof, and application thereof	20180510
CN-111819181-A	Benzo-seven-membered heterocyclic compound, preparation method, pharmaceutical composition and application thereof	20180510

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GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	110
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	160.0091207
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	160.0091207
Rotatable Bond Count:	1
Topological Polar Surface Area:	20.2 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2