AG003RZ5

35444-44-1 | Methyl adipoyl chloride

AG003RZ5

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CAS Number	35444-44-1
Catalog Number	AG003RZ5(AGN-PC-0JS9N7)
Chemical Name	Methyl adipoyl chloride
EC Number	252-569-1
IUPAC Name	methyl 6-chloro-6-oxohexanoate
InChI	InChI=1S/C7H11ClO3/c1-11-7(10)5-3-2-4-6(8)9/h2-5H2,1H3
InChI Key	HDLGIEZOMYJKAK-UHFFFAOYSA-N
MDL Number	MFCD00013661
Molecular Formula	C7H11ClO3
Molecular Weight	178.6134
SMILES	O=C(OC)CCCCC(Cl)=O
Synonyms	Methyl 6-chloro-6-oxohexanoate, 35444-44-1, Hexanedioic acid monochloride monomethyl ester, Hexanoic acid, 6-chloro-6-oxo-, methyl ester, 6-Methoxy-6-oxohexanoyl chloride, Methyl 5-(chloroformyl)pentanoate, HDLGIEZOMYJKAK-UHFFFAOYSA-N, Adipic acid monomethyl ester chloride, MFCD00013661, 5-Chlorocarbonyl-pentanoic acid methyl ester, Methyl 5-[chloroformyl]pentanoate, AC1LAUN8, mono-Methyl adipoyl chloride, 5-carbomethoxyvaleryl chloride, SCHEMBL642929, Methyl 6-chloro-6-oxocaproate, Methyl adipoyl chloride, 97%, AC1Q442X, Methyl 5-(chloroformyl)valerate, HDLGIEZOMYJKAK-UHFFFAOYSA-, Methyl 6-chloro-6-oxohexanoate #, Methyl 5-(chlorocarbonyl)pentanoate, ZINC2170334, ZX-AT006031, EINECS 252-569-1, 5-(methoxycarbonyl)pentanoyl chloride, OR4232, 6-Oxo-6-methoxyhexanoic acid chloride, AKOS005254475, ACM35444441, 6-chloro-6-oxohexanoic acid methyl ester, 5-chlorocarbonylpentanoic acid methyl ester, X-3950, InChI=1/C7H11ClO3/c1-11-7(10)5-3-2-4-6(8)9/h2-5H2,1H3, Methyl adipoyl chloride, Methyl adipyl chloride, Methyladipoylchloride, CID520737,

Complexity	145
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	178.04g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	178.612g/mol
Monoisotopic Mass	178.04g/mol
Rotatable Bond Count	6
Topological Polar Surface Area	43.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	8
Hazard statements	H302-H314-H318
Packing Group	Ⅱ
Precautionary statements	P303+P361+P353-P210-P501-P402+P404-P422-P260-P301+P330+P331-P305+P351+P338
UN Code	UN 3265

Certificate of Analysis

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