Home Carboxys 1,1'-binaphthyl-8,8'-dicarboxylic acid

1,1'-binaphthyl-8,8'-dicarboxylic acid

CAS No.:
29878-91-9
Catalog Number:
AG00BC1H
Molecular Formula:
C22H14O4
Molecular Weight:
342.3442
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Product Description
Catalog Number:
AG00BC1H
Chemical Name:
1,1'-binaphthyl-8,8'-dicarboxylic acid
CAS Number:
29878-91-9
Molecular Formula:
C22H14O4
Molecular Weight:
342.3442
MDL Number:
MFCD00027401
IUPAC Name:
8-(8-carboxynaphthalen-1-yl)naphthalene-1-carboxylic acid
InChI:
InChI=1S/C22H14O4/c23-21(24)17-11-3-7-13-5-1-9-15(19(13)17)16-10-2-6-14-8-4-12-18(20(14)16)22(25)26/h1-12H,(H,23,24)(H,25,26)
InChI Key:
XGDAODQNSVFBGM-UHFFFAOYSA-N
SMILES:
OC(=O)c1cccc2c1c(ccc2)c1cccc2c1c(ccc2)C(=O)O
EC Number:
249-922-7
NSC Number:
7810
Properties
Complexity:
496  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
342.089g/mol
Formal Charge:
0
Heavy Atom Count:
26  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
342.35g/mol
Monoisotopic Mass:
342.089g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
74.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.1  
Properties