AG003CT1

41038-40-8 | 1-(2,5-Dimethoxyphenyl)ethanol

AG003CT1

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CAS Number	41038-40-8
Catalog Number	AG003CT1(AGN-PC-009YNK)
Chemical Name	1-(2,5-Dimethoxyphenyl)ethanol
IUPAC Name	1-(2,5-dimethoxyphenyl)ethanol
InChI	InChI=1S/C10H14O3/c1-7(11)9-6-8(12-2)4-5-10(9)13-3/h4-7,11H,1-3H3
InChI Key	FOEBAVBMMWYLTA-UHFFFAOYSA-N
MDL Number	MFCD08442838
Molecular Formula	C10H14O3
Molecular Weight	182.2164
SMILES	COC1=CC(C(C)O)=C(OC)C=C1
Synonyms	1-(2,5-dimethoxyphenyl)ethanol, 41038-40-8, 120523-13-9, 156713-10-9, SCHEMBL9027230, CTK4I4179, DTXSID80473071, 1-(2,5-dimethoxyphenyl)ethan-1-ol, 5615AB, ANW-71461, MFCD08442838, AKOS000125486, TRA0034227, KS-000008W0, AS-10352, SC-27375, SY004568, AB0059322, TC-160206, FT-0690601, MFCD08442838 (96%), Z-3847, I01-9939, C10H14O3, (1R)-1-(2,5-dimethoxyphenyl)ethan-1-ol, (1S)-1-(2,5-dimethoxyphenyl)ethan-1-ol, CID11805372, 2210-93-7,

Complexity	149
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	182.094g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	182.219g/mol
Monoisotopic Mass	182.094g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	38.7A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	1.4

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

Lot Number