AG0036ZD

61644-18-6 | Chloromethyl isobutyrate

AG0036ZD

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CAS Number	61644-18-6
Catalog Number	AG0036ZD(AGN-PC-0MWUQ0)
Chemical Name	Chloromethyl isobutyrate
IUPAC Name	chloromethyl 2-methylpropanoate
InChI	InChI=1S/C5H9ClO2/c1-4(2)5(7)8-3-6/h4H,3H2,1-2H3
InChI Key	ILUWVORABZTBIU-UHFFFAOYSA-N
MDL Number	MFCD16038293
Molecular Formula	C5H9ClO2
Molecular Weight	136.5768
SMILES	C(C(C)C)(=O)OCCl
Synonyms	CHLOROMETHYL ISOBUTYRATE, 61644-18-6, Chloromethyl 2-methylpropanoate, Propanoic acid, 2-methyl-, chloromethyl ester, isobutyryloxymethyl chloride, SCHEMBL320367, CTK5B3515, DTXSID20433674, isobutyric acid chloromethyl ester, ILUWVORABZTBIU-UHFFFAOYSA-N, MFCD16038293, QC-409, ZINC22114223, AKOS006384437, CS-W018704, DS-8024, NE20509, SB21857, KS-0000083A, AK163215, SC-92989, Propanoicacid, 2-methyl-, chloromethyl ester, ST24046315, I14-16423, chloromethyl 2-methylpropionate, CID9989325,

Complexity	80.5
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	136.029g/mol
Formal Charge	0
Heavy Atom Count	8
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	136.575g/mol
Monoisotopic Mass	136.029g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	26.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	8
Hazard statements	H302-H314
Packing Group	Ⅲ
Precautionary statements	P264-P270-P301+P312-P303+P361+P353-P304+P340-P310-P321-P330-P363-P405-P501
UN Code	UN 3265

Certificate of Analysis

Lot Number