AG0037DT

5222-73-1 | 3,4-Dimethoxy-3-cyclobutene-1,2-dione

AG0037DT

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CAS Number	5222-73-1
Catalog Number	AG0037DT(AGN-PC-0JLOBN)
Chemical Name	3,4-Dimethoxy-3-cyclobutene-1,2-dione
IUPAC Name	3,4-dimethoxycyclobut-3-ene-1,2-dione
InChI	InChI=1S/C6H6O4/c1-9-5-3(7)4(8)6(5)10-2/h1-2H3
InChI Key	SZBNZTGCAMLMJY-UHFFFAOYSA-N
MDL Number	MFCD00101316
Molecular Formula	C6H6O4
Molecular Weight	142.1094
SMILES	COC1=C(C(=O)C1=O)OC
Synonyms	3,4-Dimethoxy-3-cyclobutene-1,2-dione, 5222-73-1, Dimethyl squarate, 3,4-dimethoxycyclobut-3-ene-1,2-dione, Squaric acid dimethyl ester, 3-Cyclobutene-1,2-dione, 3,4-dimethoxy-, 3,4-Dimethoxy-cyclobut-3-ene-1,2-dione, dimethoxycyclobut-3-ene-1,2-dione, MFCD00101316, AK-35466, 3-Cyclobutene-1,2-dione,3,4-dimethoxy-, 3,4-dimethoxycyclobut-3-en-1,2-dion, Dimethoxycyclobutenedione, PubChem13709, ACMC-209kyh, AC1Q6D7A, KSC498C6L, SCHEMBL239276, AC1L3W50, CTK3J8165, SZBNZTGCAMLMJY-UHFFFAOYSA-, DTXSID40200269, SZBNZTGCAMLMJY-UHFFFAOYSA-N, BB_NC-02397, KS-00000KU3, STR09811, ZINC2145277, ZX-AT005969, 1,2-dimethoxycyclobutene-3,4-dione, ANW-31431, BBL011281, SBB056248, STK940735, AKOS005669632, ACM5222731, CHM0022715, CS-W005055, FCH1117644, MCULE-7805492145, OR26829, PS-4471, RP20725, RTR-018554, 1,2-dimethoxycyclobut-1-ene-3,4-dione, 3,4-dimethoxy-3-cyclobutene-1.2-dione, AC-22925, AJ-33580, BC678241, BP-12412, CC-13211, CJ-32952, Q753, SY013540, 3,4-Dimethoxy-3-cyclobutene-1,2-dione?, AB0017789, AB1010021, AX8003560, DB-021910, TL8003447, TR-018554, AM20100285, D2099, FT-0614345, ST50823771, Dimethyl squarate; Squaric acid dimethyl ester, MFCD00101316 (98%), 22D731, M-3302, 3,4-Dimethoxy-3-cyclobutene-1,2-dione, 99%, C-02087, I14-0188, J-511209, InChI=1/C6H6O4/c1-9-5-3(7)4(8)6(5)10-2/h1-2H3, C6H6O4, C6-H6-O4, 3,4-dimethoxycyclobutane-1,2-dione, AR-1E9240, CID123227, ZINC02145277, 3,4-Dimethoxy-3-cyclobutene-1,2-dione, 99% - 1G 1g, 5331-54-4,

Complexity	202
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	142.027g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	142.11g/mol
Monoisotopic Mass	142.027g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	52.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H319-H335
Precuationary statements	P261-P305+P351+P338
Siginal words

Certificate of Analysis

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