Home Carbonyls 3-[(Cyclobutylcarbonyl)amino]-4-methylbenzoic acid

3-[(Cyclobutylcarbonyl)amino]-4-methylbenzoic acid

CAS No.:
915921-04-9
Catalog Number:
AG00GTO2
Molecular Formula:
C13H15NO3
Molecular Weight:
233.2631
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$168
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Product Description
Catalog Number:
AG00GTO2
Chemical Name:
3-[(Cyclobutylcarbonyl)amino]-4-methylbenzoic acid
CAS Number:
915921-04-9
Molecular Formula:
C13H15NO3
Molecular Weight:
233.2631
MDL Number:
MFCD08569893
IUPAC Name:
3-(cyclobutanecarbonylamino)-4-methylbenzoic acid
InChI:
InChI=1S/C13H15NO3/c1-8-5-6-10(13(16)17)7-11(8)14-12(15)9-3-2-4-9/h5-7,9H,2-4H2,1H3,(H,14,15)(H,16,17)
InChI Key:
DTAZEQDCEJDDAA-UHFFFAOYSA-N
SMILES:
O=C(C1CCC1)Nc1cc(ccc1C)C(=O)O
Properties
Complexity:
312  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.105g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
233.267g/mol
Monoisotopic Mass:
233.105g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties