AG001UPC

164220-45-5 | Benzene, 1-chloro-3-[2-(3-methoxyphenyl)ethenyl]-

AG001UPC

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CAS Number	164220-45-5
Catalog Number	AG001UPC(AGN-PC-0Q8K3A)
Chemical Name	Benzene, 1-chloro-3-[2-(3-methoxyphenyl)ethenyl]-
IUPAC Name	1-chloro-3-[2-(3-methoxyphenyl)ethenyl]benzene
InChI	InChI=1S/C15H13ClO/c1-17-15-7-3-5-13(11-15)9-8-12-4-2-6-14(16)10-12/h2-11H,1H3
InChI Key	DXHFJXLLHMOLGG-UHFFFAOYSA-N
MDL Number	MFCD01861281
Molecular Formula	C15H13ClO
Molecular Weight	244.7161
SMILES	COC1=CC(/C=C/C2=CC(Cl)=CC=C2)=CC=C1
Synonyms	164220-45-5, (E)-1-Chloro-3-(3-methoxystyryl)benzene, 1-chloro-3-[2-(3-methoxyphenyl)ethenyl]benzene, Benzene,1-chloro-3-[2-(3-methoxyphenyl)ethenyl]-, ACMC-209dqp, 3-chloro-3-methoxystilbene, 3'-chloro-3-methoxystilbene, CTK4D1753, DTXSID80697735, DXHFJXLLHMOLGG-UHFFFAOYSA-N, ANW-22079, AKOS030230973, VZ26589, DB-043584, FT-0615365, KS-00001225, A810545, 1-chloranyl-3-[2-(3-methoxyphenyl)ethenyl]benzene, 3-Chloro-3'-methoxystilbene,

Complexity	251
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	244.065g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	244.718g/mol
Monoisotopic Mass	244.065g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	9.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	1
XLogP3	4.8

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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