AG007D0Y

17253-11-1 | 2-(2,3-Dihydrobenzo[b][1,4]dioxin-6-yl)acetic acid

AG007D0Y

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CAS Number	17253-11-1
Catalog Number	AG007D0Y(AGN-PC-0JLWIW)
Chemical Name	2-(2,3-Dihydrobenzo[b][1,4]dioxin-6-yl)acetic acid
EC Number	241-286-9
IUPAC Name	2-(2,3-dihydro-1,4-benzodioxin-6-yl)acetic acid
InChI	InChI=1S/C10H10O4/c11-10(12)6-7-1-2-8-9(5-7)14-4-3-13-8/h1-2,5H,3-4,6H2,(H,11,12)
InChI Key	BVRNERFWPQRVJB-UHFFFAOYSA-N
MDL Number	MFCD00066923
Molecular Formula	C10H10O4
Molecular Weight	194.1840
SMILES	OC(=O)CC1=CC2=C(OCCO2)C=C1
Synonyms	17253-11-1, 2-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)acetic acid, (2,3-Dihydro-benzo[1,4]dioxin-6-yl)-acetic acid, 1,4-Benzodioxan-6-ylacetic acid, 2-(2,3-dihydro-1,4-benzodioxin-6-yl)acetic acid, 2,3-dihydro-1,4-benzodioxin-6-ylacetic acid, CHEMBL235786, 1,4-benzodioxin-6-acetic acid, 2,3-dihydro-, 2-(2H,3H-benzo[3,4-e]1,4-dioxin-6-yl)acetic acid, 1,4-benzodioxan-6-ylaceticacid, EINECS 241-286-9, PubChem17716, BAS 12968447, Enamine_005765, AC1L3CS6, AC1Q5VJ7, AC1Q74ZQ, Oprea1_471639, SCHEMBL286952, 1,4-benzodioxane-6-acetic acid, CTK0H7192, DTXSID00169343, BVRNERFWPQRVJB-UHFFFAOYSA-N, HMS1410G01, ZINC3750721, 8884AA, ANW-66336, BDBM50213566, MFCD00066923, SBB010906, STK279214, AKOS000117663, CCG-120458, MCULE-3823468718, 1,4-Benzodioxane-6-acetic acid, 97%, IDI1_008000, AJ-45534, BS-13882, AB1006326, DB-011454, ST4143452, TR-007600, 2,3-Dihydro-1,4-benzodioxin-6-acetic acid, BB 0248975, FT-0677801, 1,4-Benzodioxin-6-aceticacid, 2,3-dihydro-, EN300-05691, Z-0289, 2-(2,3-dihydro-1,4-benzodioxin-6-yl) acetic acid, I01-16025, I14-12507, Z56921840, null, KST-1B1012, C10H10O4, CID87020, AR-1B7487, C10-H10-O4, A3802, 17611-16-4,

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	1
Isotope Atom Count	0
Molecular Weight	194.186g/mol
Monoisotopic Mass	194.058g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	55.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.3

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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