AG000WTT

127264-09-9 | 2-(2,3-Dihydro-1,4-benzodioxin-6-yl)ethan-1-ol

AG000WTT

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CAS Number	127264-09-9
Catalog Number	AG000WTT(AGN-PC-02JHYN)
Chemical Name	2-(2,3-Dihydro-1,4-benzodioxin-6-yl)ethan-1-ol
IUPAC Name	2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanol
InChI	InChI=1S/C10H12O3/c11-4-3-8-1-2-9-10(7-8)13-6-5-12-9/h1-2,7,11H,3-6H2
InChI Key	ZWKJGSFAORXDED-UHFFFAOYSA-N
MDL Number	MFCD09926232
Molecular Formula	C10H12O3
Molecular Weight	180.2005
SMILES	OCCC1=CC=C2OCCOC2=C1
Synonyms	2-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)ethanol, 127264-09-9, 2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethan-1-ol, SCHEMBL3777135, DTXSID70599517, ZWKJGSFAORXDED-UHFFFAOYSA-N, ZINC19729364, AKOS012084726, MCULE-4041678494, NE45141, RL01359, AJ-74512, NS-01563, 1,4-Benzodioxin-6-ethanol, 2,3-dihydro-, 2-(2,3-Dihydro-benzo[1,4]dioxin-6-yl)-ethanol, J-505459,

Complexity	160
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	180.079g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	180.203g/mol
Monoisotopic Mass	180.079g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	38.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.3

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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