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

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

CAS No.:
915923-66-9
Catalog Number:
AG006GIZ
Molecular Formula:
C12H13NO3
Molecular Weight:
219.2365
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:
AG006GIZ
Chemical Name:
3-[(Cyclopropylcarbonyl)amino]-4-methylbenzoic acid
CAS Number:
915923-66-9
Molecular Formula:
C12H13NO3
Molecular Weight:
219.2365
MDL Number:
MFCD08569890
IUPAC Name:
3-(cyclopropanecarbonylamino)-4-methylbenzoic acid
InChI:
InChI=1S/C12H13NO3/c1-7-2-3-9(12(15)16)6-10(7)13-11(14)8-4-5-8/h2-3,6,8H,4-5H2,1H3,(H,13,14)(H,15,16)
InChI Key:
STZOVMPEFUHQCM-UHFFFAOYSA-N
SMILES:
O=C(C1CC1)Nc1cc(ccc1C)C(=O)O
Properties
Complexity:
299  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.09g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
219.24g/mol
Monoisotopic Mass:
219.09g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties