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123371-80-2 | Lithium, (3-methyl-5-phenyl-4-isoxazolyl)-
CAS No: 123371-80-2 Catalog No: AG000KG9 MDL No:
Product Description
Catalog Number:
AG000KG9
Chemical Name:
Lithium, (3-methyl-5-phenyl-4-isoxazolyl)-
CAS Number:
123371-80-2
Molecular Formula:
C10H8LiNO
Molecular Weight:
165.1176
IUPAC Name:
lithium;3-methyl-5-phenyl-4H-1,2-oxazol-4-ide
InChI:
InChI=1S/C10H8NO.Li/c1-8-7-10(12-11-8)9-5-3-2-4-6-9;/h2-6H,1H3;/q-1;+1
InChI Key:
FDSJXEBNCHIPKV-UHFFFAOYSA-N
SMILES:
Cc1noc(c1[Li])c1ccccc1
Properties
Complexity:
229
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
165.077g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
165.12g/mol
Monoisotopic Mass:
165.077g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
21.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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