5-Chloropentanal - CAS 20074-80-0

Catalog:	BB015634
Product Name:	5-Chloropentanal
CAS:	20074-80-0
Synonyms:	5-chloropentanal; 5-chloropentanal

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Computed Properties

IUPAC Name:	5-chloropentanal
Description:	5-Chloropentanal (CAS# 20074-80-0) is a useful research chemical.
Molecular Weight:	120.58
Molecular Formula:	C5H9ClO
Canonical SMILES:	C(CCCl)CC=O
InChI:	InChI=1S/C5H9ClO/c6-4-2-1-3-5-7/h5H,1-4H2
InChI Key:	ZNLHWEDEIKEQDK-UHFFFAOYSA-N
Boiling Point:	172 °C at 760 mmHg
Density:	1.006 g/cm³
MDL:	MFCD09753736
LogP:	1.59440

Publication Number	Title	Priority Date
CN-112979537-A	Preparation method of cocaine drug intermediate (S) -2-piperidinecarboxylic acid	20210223
CN-111454227-A	Preparation method of cilostazol intermediate	20200521
CN-111233795-A	Preparation method and application of chiral gamma-butyrolactone compound and derivative thereof	20200227
CN-110563535-A	method for synthesizing 1, 2-disubstituted olefin compound by alkyne alkylation	20190828
CN-111825669-A	Preparation method of intermediate	20190419

PMID	Publication Date	Title	Journal
17929934	20071108	Asymmetric synthesis of (-)-1-hydroxyquinolizidinone, a common intermediate for the syntheses of (-)-homopumiliotoxin 223G and (-)-epiquinamide	Organic letters

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Related Functional Groups

Carbonyl Compounds

[5650-34-0]
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[35153-16-3]
(Z)-10-Tetradecenyl Acetate
[1018141-88-2]
1-(2-Cyanoethyl)-3-methyl-6-phenyl-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid
[70912-52-6]
1,3-Dioxane-4,6-dione,2,2-dimethyl-5-(2-pyrrolidinylidene)-
[1431966-64-1]
1-{2-[(3-Methoxypropyl)amino]-4-methyl-1,3-thiazol-5-yl}ethanone hydrochloride
[91552-11-3]
2-(3-Chlorophenyl)cyclopropanecarboxylic Acid

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GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]; H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement:	P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	45.3
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	120.0341926
Formal Charge:	0
Heavy Atom Count:	7
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	120.0341926
Rotatable Bond Count:	4
Topological Polar Surface Area:	17.1
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1