2-Ethylhexanoyl chloride - CAS 760-67-8

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

Catalog:	BB035492
Product Name:	2-Ethylhexanoyl chloride
CAS:	760-67-8
Synonyms:	2-ethylhexanoyl chloride

Technical Data

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Patents

Computed Properties

IUPAC Name:	2-ethylhexanoyl chloride
Description:	2-Ethylhexanoyl chloride (CAS# 760-67-8) is a useful research chemical compound.
Molecular Weight:	162.66
Molecular Formula:	C8H15ClO
Canonical SMILES:	CCCCC(CC)C(=O)Cl
InChI:	InChI=1S/C8H15ClO/c1-3-5-6-7(4-2)8(9)10/h7H,3-6H2,1-2H3
InChI Key:	WFSGQBNCVASPMW-UHFFFAOYSA-N
Boiling Point:	67-68 °C (11 mmHg)
Purity:	98 %
Density:	0.939 g/cm³
Appearance:	Clear colourless to greyish liquid
Storage:	Keep away from sources of ignition. Store in a cool, dry place. Store in a tightly closed container. Corrosives area.
MDL:	MFCD00000718
LogP:	2.96820

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Related Functional Groups

Carbonyl Compounds

[89908-23-6]C23H22N2O5
2-Propenoic acid, 2-(3',3'-dimethyl-6-nitrospiro[2H-1-benzopyran-2,2'-[2H]indol]-1'(3'H)-yl)ethyl ester
[1018141-88-2]C17H14N4O2
1-(2-Cyanoethyl)-3-methyl-6-phenyl-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid
[1035840-45-9]C14H16N2O4
1-(5-Methoxy-1,3-benzoxazol-2-yl)piperidine-3-carboxylic acid
[91552-11-3]C10H9ClO2
2-(3-Chlorophenyl)cyclopropanecarboxylic Acid
[957292-12-5]C8H10N2O2
2-(3-Cyclopropyl-1H-pyrazol-1-yl)acetic acid
[438616-66-1]C14H20N2O
2-(4-Tert-Butylphenyl)cyclopropanecarbohydrazide

GHS Hazard Statement:	H290 (96.5%): May be corrosive to metals [Warning Corrosive to Metals]
Precautionary Statement:	P234, P260, P261, P264, P270, P271, P272, P280, P284, P301+P312, P301+P330+P331, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P310, P320, P321, P330, P333+P313, P363, P390, P403+P233, P404, P405, and P501
Signal Word:	Danger

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Complexity:	101
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	162.0811428
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	162.0811428
Rotatable Bond Count:	5
Topological Polar Surface Area:	17.1 Å²
Undefined Atom Stereocenter Count:	1
Undefined Bond Stereocenter Count:	0
XLogP3:	3.6