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400750-15-4

400750-15-4 | 2'-(1,3-Dioxolan-2-yl)biphenyl-3-carboxylic acid

CAS No: 400750-15-4 Catalog No: AG003EOY MDL No:MFCD06210041

Product Description

Catalog Number:
AG003EOY
Chemical Name:
2'-(1,3-Dioxolan-2-yl)biphenyl-3-carboxylic acid
CAS Number:
400750-15-4
Molecular Formula:
C16H14O4
Molecular Weight:
270.2800
MDL Number:
MFCD06210041
IUPAC Name:
3-[2-(1,3-dioxolan-2-yl)phenyl]benzoic acid
InChI:
InChI=1S/C16H14O4/c17-15(18)12-5-3-4-11(10-12)13-6-1-2-7-14(13)16-19-8-9-20-16/h1-7,10,16H,8-9H2,(H,17,18)
InChI Key:
POQPRIGYDJGXPC-UHFFFAOYSA-N
SMILES:
OC(=O)c1cccc(c1)c1ccccc1C1OCCO1

Properties

Complexity:
337  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
270.089g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
270.284g/mol
Monoisotopic Mass:
270.089g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  

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