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1131614-72-6

1131614-72-6 | 3-Iodo-4-(MorpholinoMethyl)benzoic acid

CAS No: 1131614-72-6 Catalog No: AG00HCN3 MDL No:

Product Description

Catalog Number:
AG00HCN3
Chemical Name:
3-Iodo-4-(MorpholinoMethyl)benzoic acid
CAS Number:
1131614-72-6
IUPAC Name:
3-iodo-4-(morpholin-4-ylmethyl)benzoic acid
InChI:
InChI=1S/C12H14INO3/c13-11-7-9(12(15)16)1-2-10(11)8-14-3-5-17-6-4-14/h1-2,7H,3-6,8H2,(H,15,16)
InChI Key:
OUYSDHPSLQGXPM-UHFFFAOYSA-N

Properties

Complexity:
269  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
347.002g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
347.152g/mol
Monoisotopic Mass:
347.002g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
49.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.7  

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