Home Other Building Blocks lithium(1+) ion 3-(2-hydroxy-4-methylphenyl)butanoate

lithium(1+) ion 3-(2-hydroxy-4-methylphenyl)butanoate

CAS No.:
1803588-65-9
Catalog Number:
AG01BHDH
Molecular Formula:
C11H13LiO3
Molecular Weight:
200.1601
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Product Description
Catalog Number:
AG01BHDH
Chemical Name:
lithium(1+) ion 3-(2-hydroxy-4-methylphenyl)butanoate
CAS Number:
1803588-65-9
Molecular Formula:
C11H13LiO3
Molecular Weight:
200.1601
MDL Number:
MFCD28139602
IUPAC Name:
lithium;3-(2-hydroxy-4-methylphenyl)butanoate
InChI:
InChI=1S/C11H14O3.Li/c1-7-3-4-9(10(12)5-7)8(2)6-11(13)14;/h3-5,8,12H,6H2,1-2H3,(H,13,14);/q;+1/p-1
InChI Key:
AAZQAURVHLSAOS-UHFFFAOYSA-M
SMILES:
[O-]C(=O)CC(c1ccc(cc1O)C)C.[Li+]
Properties
Complexity:
208  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.102g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
200.162g/mol
Monoisotopic Mass:
200.102g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
60.4A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties