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141240-72-4 | Lithium, [2-[(4-methoxyphenyl)ethynyl]phenyl]- (9CI)
CAS No: 141240-72-4 Catalog No: AG001G4V MDL No:
Product Description
Catalog Number:
AG001G4V
Chemical Name:
Lithium, [2-[(4-methoxyphenyl)ethynyl]phenyl]- (9CI)
CAS Number:
141240-72-4
Molecular Formula:
C15H11LiO
Molecular Weight:
214.1882
IUPAC Name:
lithium;1-methoxy-4-(2-phenylethynyl)benzene
InChI:
InChI=1S/C15H11O.Li/c1-16-15-11-9-14(10-12-15)8-7-13-5-3-2-4-6-13;/h2-5,9-12H,1H3;/q-1;+1
InChI Key:
JQYZSEONGRTBNS-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)C#Cc1ccccc1[Li]
Properties
Complexity:
384
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.097g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
214.192g/mol
Monoisotopic Mass:
214.097g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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