AG002X38

2892-51-5 | 3-Cyclobutene-1,2-dione, 3,4-dihydroxy-

AG002X38

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CAS Number	2892-51-5
Catalog Number	AG002X38(AGN-PC-00UNEF)
Chemical Name	3-Cyclobutene-1,2-dione, 3,4-dihydroxy-
IUPAC Name	3,4-dihydroxycyclobut-3-ene-1,2-dione
InChI	InChI=1S/C4H2O4/c5-1-2(6)4(8)3(1)7/h5-6H
InChI Key	PWEBUXCTKOWPCW-UHFFFAOYSA-N
MDL Number	MFCD00001334
Molecular Formula	C4H2O4
Molecular Weight	114.0563
SMILES	O=C1C(C(O)=C1O)=O
UNII	SVR9D0VODW
Synonyms	squaric acid, squaric acid, dipotassium salt, squaric acid, disilver (+1) salt, squaric acid, disodium salt, squaric acid, monopotassium salt, squaric acid, monopotassium salt monohydrate, squaric acid, nickel (+2), (1:1) salt dihydrate, Squaric acid, 3,4-Dihydroxy-3-cyclobutene-1,2-dione, 2892-51-5, Quadratic acid, 3,4-dihydroxycyclobut-3-ene-1,2-dione, 3-Cyclobutene-1,2-dione, 3,4-dihydroxy-, Quadratsaeure, Cyclobutenedione, dihydroxy-, 1,2-Diketo-3,4-dihydroxycyclobutene, dihydroxycyclobut-3-ene-1,2-dione, Dihydroxycyclobutenedione, UNII-SVR9D0VODW, 1,2-Dihydroxycyclobutene-3,4-dione, 1,2-Dihydroxycyclobutenedione, 3,4-Dihydroxy-cyclobutene-1,2-dione, NSC 125692, CCRIS 6793, SVR9D0VODW, EINECS 220-761-4, MFCD00001334, CYCLOBUTENE-1,2-DIONE, 3,4-DIHYDROXY-, BRN 0774275, AI3-61444, PWEBUXCTKOWPCW-UHFFFAOYSA-N, 1,2-dioxo-3,4-dihydroxycyclobutene, NSC624671, 1,2-dioxo-3,4-dihydroxycyclobut-3-ene, 1,2-DIHYDROXY-1-CYCLOBUTEN-3,4-DIONE, 3,4-Dihydroxy-3-cyclobutene-1,2-dione, 99%, 3,4-dihydroxy-3-cyclobutene-2-dione;QUADRATIC ACID, 1,2-DIHYDROXY CYCLOBUTENEDIONE, 3,2-dione, 3,4-Dihydroxy-3-cyclobuten-1,2-dion, PubChem13708, 1,4-dihydroxycyclobutene, ACMC-209h5o, 3,4-Dihydroxy-3-cyclobuten-1,2-dion [IUPAC], WLN: L4VVTJ CQ DQ, DSSTox_CID_29369, DSSTox_RID_83484, DSSTox_GSID_49409, SCHEMBL56172, 4-08-00-02701 (Beilstein Handbook Reference), KSC498E4T, C4H2O4, DTXSID9049409, CHEBI:52141, CTK3J8249, Cyclobutene-1, 3,4-dihydroxy-, 3-Cyclobutene-1, 3,4-dihydroxy-, STR05257, ZINC1714721, Cyclobutenedione, dihydroxy- (8CI), Tox21_202819, 1,2-Dihydroxy-3,4-cyclobutenedione, ANW-26506, BBL011240, NSC125692, SBB007891, STK936793, 1-Cyclobutene-3,4-dione-1,2-diol, AKOS000121580, CM14389, CS-W019969, LS41695, MCULE-1517845681, NE10090, NSC 624671, NSC-125692, NSC-624671, RTC-068744, SB11012, 1,2-dihydroxy-l-cyclobutene-3,4-dione, 3,4-dihydroxy-3-cyclobuten-1,2-dione, 1,2-dihydroxy-1-cyclobutene-3,4-dione, NCGC00260365-01, AC-22924, AK-34541, BP-10690, LS-55931, SC-46584, SY002206, 3,4-dihydroxy-cyclobut-3-ene-1,2-dione, 3-Cyclobutene-1,2-dione,3,4-dihydroxy-, CAS-2892-51-5, AB1010020, DB-028257, TC-068744, 3,4-bis(oxidanyl)cyclobut-3-ene-1,2-dione, AM20090382, D1399, FT-0614321, ST24028187, ST50828271, MFCD00001334 (95%), 892D515, A819678, Q903298, J-511200, Q3008466, Z56347217, F0001-0904, InChI=1/C4H2O4/c5-1-2(6)4(8)3(1)7/h5-6, 3,4-Dihydroxy-3-cyclobutene-1,2-dione, Lonza quality, 98.50-101.00% (w/w) (HPLC), Cyclobutanetetrone, Diketocyclobutenediol, cyclobutene-1,2-dione, AC1L2AXZ, 1,4-DIONE, C4-H2-O4, CID17913, ACN-026807, FR-0532, RP08179, 3,4-Dihydroxycyclobut-3-en-1,2-dion, AJ-30837, AN-20191, BC213507, CJ-29075, TL8002282, 3,4-Dihydroxy-3-cyclobutene-1,2-dione, 98% 1g, I14-0603, 3,4-Dihydroxy-3-cyclobutene-1,2-dione, 99% - 25G 25g,

Complexity	178
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	113.995309g/mol
Formal Charge	0
Heavy Atom Count	8
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	114.06g/mol
Monoisotopic Mass	113.995309g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	74.6Ų
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H317-H319-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code	\N

Certificate of Analysis

Lot Number