AG0033UY

4220-66-0 | 4,4-Dimethoxybutanoic acid methyl ester

AG0033UY

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CAS Number	4220-66-0
Catalog Number	AG0033UY(AGN-PC-0WAFWC)
Chemical Name	4,4-Dimethoxybutanoic acid methyl ester
IUPAC Name	methyl 4,4-dimethoxybutanoate
InChI	InChI=1S/C7H14O4/c1-9-6(8)4-5-7(10-2)11-3/h7H,4-5H2,1-3H3
InChI Key	MMRXJPOAPCEDLP-UHFFFAOYSA-N
MDL Number	MFCD02683436
Molecular Formula	C7H14O4
Molecular Weight	162.1837
NSC Number	516374
SMILES	COC(CCC(OC)OC)=O
Synonyms	4220-66-0, Methyl 4,4-dimethoxybutyrate, methyl 4,4-dimethoxybutanoate, 4,4-Dimethoxybutanoic Acid Methyl Ester, 4,4-dimethoxybutyric acid methyl ester, NSC516374, ACMC-20amsp, AC1L6X3Z, SCHEMBL322568, methyl 4,4-dimethoxy-butyrate, CS-WAA0013, methyl 4,4-dimethoxy-butanoate, CTK4I5854, DTXSID80325708, MMRXJPOAPCEDLP-UHFFFAOYSA-N, ZINC1604392, ZX-AL000221, Methyl 4,4-dimethoxybutyrate, 97%, MFCD02683436, AKOS000319904, ACM4220660, CS-W016118, NSC-516374, TRA-0189432, TZ001046, Butanoic acid,4,4-dimethoxy-,methyl ester, METHYL 4 4-DIMETHOXYBUTYRATE 97, DB-070270, TC-169216, FT-0667283, I04-9451, CID350846,

Complexity	109
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	162.089g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	162.185g/mol
Monoisotopic Mass	162.089g/mol
Rotatable Bond Count	6
Topological Polar Surface Area	44.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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