AG00355A

3663-79-4 | 1,4-Benzodioxin-2-carboxylicacid, 2,3-dihydro-, methyl ester

AG00355A

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CAS Number	3663-79-4
Catalog Number	AG00355A(AGN-PC-0JVNVR)
Chemical Name	1,4-Benzodioxin-2-carboxylicacid, 2,3-dihydro-, methyl ester
IUPAC Name	methyl 2,3-dihydro-1,4-benzodioxine-3-carboxylate
InChI	InChI=1S/C10H10O4/c1-12-10(11)9-6-13-7-4-2-3-5-8(7)14-9/h2-5,9H,6H2,1H3
InChI Key	SNLAAGHHNZECPE-UHFFFAOYSA-N
MDL Number	MFCD00297092
Molecular Formula	C10H10O4
Molecular Weight	194.1840
SMILES	O=C(C1OC2=CC=CC=C2OC1)OC
Synonyms	3663-79-4, methyl 2,3-dihydro-1,4-benzodioxine-2-carboxylate, Methyl 1,4-Benzodioxane-2-carboxylate, methyl 1,4-benzodioxan-2-carboxylate, Methyl 2,3-dihydrobenzo[b][1,4]dioxine-2-carboxylate, 2,3-Dihydro-benzo[1,4]dioxine-2-carboxylic acid methyl ester, BAS 00258350, 1,4-Benzodioxin-2-carboxylic acid, 2,3-dihydro-, methyl ester, methyl 2,3-dihydro-1,4-benzodioxine-3-carboxylate, 2,3-dihydro-benzo[1,4]dioxine-2-carboxylic acidmethyl ester, 1,4-Benzodioxin-2-carboxylicacid, 2,3-dihydro-, methyl ester, ZERO/005239, PubChem2381, AC1MJQNE, Enamine_004749, AC1Q43YG, SCHEMBL7491132, CTK4H6930, KS-00000BKJ, DTXSID50389175, SNLAAGHHNZECPE-UHFFFAOYSA-N, HMS1407H19, 1716AE, BBL020130, MFCD00297092, SBB010908, STK182756, Methyl1,4-Benzodioxane-2-carboxylate, AKOS000301547, AKOS016313895, MCULE-9892797934, TRA0000019, CS-11285, SY014175, DB-069412, ST4111316, TR-014979, BB 0218192, FT-0678666, H8247, EN300-15475, 1,4-Benzodioxane-2-carboxylic acid methyl ester, methyl 2H,3H-benzo[e]1,4-dioxin-2-carboxylate, MFCD00297092 (97+%), AO-365/40129133, methyl 2H,3H-benzo[e]1,4-dioxane-2-carboxylate, I14-20184, 2,3-dihydro-1,4-Benzodioxin-2-carboxylic acid Methyl ester, 2,3-Dihydrobenzo[1,4]dioxine-2-carboxylic acid, methyl ester, C10H10O4, Methyl1,4-benzodioxan-2-carboxylate, CID3096253,

Complexity	216
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	194.058g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	194.186g/mol
Monoisotopic Mass	194.058g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	44.8A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	1.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P280-P301+P312-P302+P352-P305+P351+P338
UN Code

Certificate of Analysis

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