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1261760-34-2

1261760-34-2 | Benzenepropanoic acid, 3-hydroxy-4-iodo-

CAS No: 1261760-34-2 Catalog No: AG000RZL MDL No:MFCD18397149

Product Description

Catalog Number:
AG000RZL
Chemical Name:
Benzenepropanoic acid, 3-hydroxy-4-iodo-
CAS Number:
1261760-34-2
Molecular Formula:
C9H9IO3
Molecular Weight:
292.0704
MDL Number:
MFCD18397149
IUPAC Name:
3-(3-hydroxy-4-iodophenyl)propanoic acid
InChI:
InChI=1S/C9H9IO3/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1,3,5,11H,2,4H2,(H,12,13)
InChI Key:
MEYVAUWSOGWLLP-UHFFFAOYSA-N
SMILES:
OC(=O)CCc1ccc(c(c1)O)I

Properties

Complexity:
184  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
291.96g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
292.072g/mol
Monoisotopic Mass:
291.96g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
57.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  

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