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Home Other Building Blocks 3-Methyl-4-morpholin-4-yl-benzoic acid

3-Methyl-4-morpholin-4-yl-benzoic acid

CAS No.:
197445-65-1
Catalog Number:
AG002ASV
Molecular Formula:
C12H15NO3
Molecular Weight:
221.2524
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$289
- +
5g
95%
In Stock USA
United States
$858
- +
Product Description
Catalog Number:
AG002ASV
Chemical Name:
3-Methyl-4-morpholin-4-yl-benzoic acid
CAS Number:
197445-65-1
Molecular Formula:
C12H15NO3
Molecular Weight:
221.2524
MDL Number:
MFCD08445782
IUPAC Name:
3-methyl-4-morpholin-4-ylbenzoic acid
InChI:
InChI=1S/C12H15NO3/c1-9-8-10(12(14)15)2-3-11(9)13-4-6-16-7-5-13/h2-3,8H,4-7H2,1H3,(H,14,15)
InChI Key:
WFJKSKWRBZDCKE-UHFFFAOYSA-N
SMILES:
Cc1cc(ccc1N1CCOCC1)C(=O)O
Properties
Complexity:
251  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.105g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
221.256g/mol
Monoisotopic Mass:
221.105g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
49.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties