AG000YVJ

129113-00-4 | Naphthalene, 2-ethynyl-6-methoxy-

AG000YVJ

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CAS Number	129113-00-4
Catalog Number	AG000YVJ(AGN-PC-0LDPZT)
Chemical Name	Naphthalene, 2-ethynyl-6-methoxy-
IUPAC Name	2-ethynyl-6-methoxynaphthalene
InChI	InChI=1S/C13H10O/c1-3-10-4-5-12-9-13(14-2)7-6-11(12)8-10/h1,4-9H,2H3
InChI Key	PATPLTUFXUXNDY-UHFFFAOYSA-N
MDL Number	MFCD00089947
Molecular Formula	C13H10O
Molecular Weight	182.2179
SMILES	COC1=CC2=CC=C(C#C)C=C2C=C1
Synonyms	2-Ethynyl-6-methoxynaphthalene, 129113-00-4, Naphthalene, 2-ethynyl-6-methoxy-, 2-ethynyl-6-methoxy-naphthalene, ACMC-20dzbz, AC1Q4ETB, AC1NE4T9, SCHEMBL936832, CTK0F6051, DTXSID70404571, PATPLTUFXUXNDY-UHFFFAOYSA-N, ZINC2172212, MFCD00089947, 2-Ethynyl-6-methoxynaphthalene, 97%, AKOS015916464, FCH1120351, MCULE-5675494865, RL01406, KS-000018V1, AJ-34084, BBV-39692844, RT-007756, FT-0691670, A1-02124, J-509344, I14-51290, CID4586522,

Complexity	237
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	182.073g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	182.222g/mol
Monoisotopic Mass	182.073g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	9.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H318-H410
Precuationary statements	P273-P280-P305+P351+P338
Siginal words

Certificate of Analysis

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