AG0035N9

42726-73-8 | tert-Butyl methyl malonate

AG0035N9

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CAS Number	42726-73-8
Catalog Number	AG0035N9(AGN-PC-0KK68Q)
Chemical Name	tert-Butyl methyl malonate
EC Number	255-919-1
IUPAC Name	3-O-tert-butyl 1-O-methyl propanedioate
InChI	InChI=1S/C8H14O4/c1-8(2,3)12-7(10)5-6(9)11-4/h5H2,1-4H3
InChI Key	XPSYZCWYRWHVCC-UHFFFAOYSA-N
MDL Number	MFCD00042856
Molecular Formula	C8H14O4
Molecular Weight	174.1944
SMILES	O=C(OC)CC(=O)OC(C)(C)C
Synonyms	tert-Butyl methyl malonate, 42726-73-8, t-butyl methyl malonate, MFCD00042856, 1-tert-butyl 3-methyl propanedioate, GEO-00623, AK-47376, W-200369, tert.-Butyl methyl malonate, 95%, EINECS 255-919-1, ACMC-20ajkv, AC1MBZUR, PubChem20476, methyl tert-butyl malonate, KSC493C8H, SCHEMBL332199, CTK3J3183, DTXSID40195404, tert-Butyl methyl malonate, 95%, XPSYZCWYRWHVCC-UHFFFAOYSA-N, ACN-S002271, ACN-S004152, ACT06801, BCP21701, KS-000001AX, TERT-BUTYL METHYL MALONAOATE, ZINC2584404, Malonic acid tert-butyl methyl ester, DT1680, AKOS015892872, O3-tert-butyl O1-methyl propanedioate, CM14339, CS-W008068, RTR-016678, TRA0083506, ACM42726738, 3-O-tert-butyl 1-O-methyl propanedioate, AJ-43436, AS-19096, BP-12790, BR-47376, Malonic acid 1-methyl 3-tert-butyl ester, OR350045, SC-27040, SY004969, malonic acid tert-butyl ester methyl ester, AB0006470, AX8153024, DB-070333, TR-016678, FT-0654034, ST24031862, X4466, S-1383, MFCD00042856 (95+%), A825993, C-48161, propanedioic acid, 1,1-dimethylethyl methyl ester, I04-1004, propanedioic acid O3-tert-butyl ester O1-methyl ester, tert-butyl methylmalote, tert-BUTYL METHYLMALONATE, C8H14O4, C8-H14-O4, tert-Butyl methyl malonate, 95% 2ml, CID2733872, tert-Butyl methyl malonate, 95% - 1ML 1ml,

Complexity	178
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	174.089g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	174.196g/mol
Monoisotopic Mass	174.089g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	52.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H227-H315-H319-H335
Packing Group
Precautionary statements	P305+P351+P338
UN Code

Certificate of Analysis

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