AG003PLA

4131-74-2 | Dimethyl 3,3'-thiodipropanoate

AG003PLA

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CAS Number	4131-74-2
Catalog Number	AG003PLA(AGN-PC-0JLQXQ)
Chemical Name	Dimethyl 3,3'-thiodipropanoate
EC Number	223-948-9
IUPAC Name	methyl 3-(3-methoxy-3-oxopropyl)sulfanylpropanoate
InChI	InChI=1S/C8H14O4S/c1-11-7(9)3-5-13-6-4-8(10)12-2/h3-6H2,1-2H3
InChI Key	MYWWWNVEZBAKHR-UHFFFAOYSA-N
MDL Number	MFCD00008465
Molecular Formula	C8H14O4S
Molecular Weight	206.2594
SMILES	O=C(OC)CCSCCC(OC)=O
UNII	4QGO9S8DSC
Synonyms	4131-74-2, Dimethyl 3,3'-thiodipropionate, dimethyl 3,3'-thiodipropanoate, Dimethyl thiodipropionate, Propanoic acid, 3,3'-thiobis-, dimethyl ester, UNII-4QGO9S8DSC, Bis(2-methoxycarbonylethyl)sulfide, 3,3'-Thiobis(methyl propionate), 4QGO9S8DSC, methyl 3-[(3-methoxy-3-oxopropyl)sulfanyl]propanoate, 3,3'-Thiodipropionic acid dimethyl ester, Dimethyl 3,3-Thiodipropionate, Propionic acid, 3,3'-thiodi-, dimethyl ester, MYWWWNVEZBAKHR-UHFFFAOYSA-N, Propanoic acid, 3,3'-thiobis-, 1,1'-dimethyl ester, .beta.,.beta.'-Dicarbomethoxydiethyl sulfide, methyl 3-(3-methoxy-3-oxopropyl)sulfanylpropanoate, Propionic acid,3'-thiodi-, dimethyl ester, Propanoic acid,3'-thiobis-, dimethyl ester, Dimethyl3,3'-thiodipropanoate, C8H14O4S, Dimethyl 3,3'-thiobispropionate, NSC 2244, EINECS 223-948-9, NSC 35224, beta,beta'-Dicarbomethoxydiethyl sulfide, ACMC-1AKFE, AC1L2TSZ, DSSTox_CID_7561, DSSTox_RID_78505, DSSTox_GSID_27561, SCHEMBL112204, AC1Q601F, CHEMBL1899866, DTXSID0027561, CTK4I4682, MYWWWNVEZBAKHR-UHFFFAOYSA-, NSC2244, Thiodipropionic acid dimethyl ester, AC1Q4450, KS-00000W6H, NSC-2244, NSC35224, ZINC1577229, Tox21_303275, ANW-29606, MFCD00008465, NSC-35224, 3,3'-Thiobis(propionic acid methyl), AKOS005216360, MCULE-8773115535, NE10586, RP26237, VZ35995, 3,3'-Thiopropionic acid dimethyl ester, 3,3-Thiodipropionic Acid Dimethyl Ester, NCGC00164219-01, NCGC00257115-01, AN-18845, AS-40955, CJ-25034, SC-48676, CAS-4131-74-2, RT-002524, FT-0614102, EN300-18958, A825515, methyl 3-[(3-methoxy-3-oxopropyl)thio]propanoate, J-520361, J-650342, methyl 3-(3-methoxy-3-oxo-propyl)sulfanylpropanoate, S14-1229, Propanoic acid,3,3'-thiobis-, 1,1'-dimethyl ester, Dimethyl 3,3 inverted exclamation marka-thiodipropionate, Z102926714, 3-[(3-methoxy-3-oxopropyl)thio]propanoic acid methyl ester, methyl 3-(3-methoxy-3-oxidanylidene-propyl)sulfanylpropanoate, 3,3 inverted exclamation marka-Thiodipropionic acid dimethyl ester, InChI=1/C8H14O4S/c1-11-7(9)3-5-13-6-4-8(10)12-2/h3-6H2,1-2H3, 3,3/'-Thiobis(methyl propionate), C8-H14-O4-S, CID77781, AR-1I5523, R118, T0901, Dimethyl 3,3'-Thiodipropionate, 98% - 25ML 25ml, 56532-53-7,

Complexity	152
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	206.061g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	206.256g/mol
Monoisotopic Mass	206.061g/mol
Rotatable Bond Count	8
Topological Polar Surface Area	77.9A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P264-P270-P301+P312-P330
UN Code

Certificate of Analysis

Lot Number