Home Carbonyls 3-[(tert-Butoxycarbonyl)amino]-5-hydroxybenzoic acid

3-[(tert-Butoxycarbonyl)amino]-5-hydroxybenzoic acid

CAS No.:
232595-59-4
Catalog Number:
AG002MON
Molecular Formula:
C12H15NO5
Molecular Weight:
253.2512
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
≥95%
In Stock USA
United States
$144
- +
5g
≥95%
In Stock USA
United States
$394
- +
Product Description
Catalog Number:
AG002MON
Chemical Name:
3-[(tert-Butoxycarbonyl)amino]-5-hydroxybenzoic acid
CAS Number:
232595-59-4
Molecular Formula:
C12H15NO5
Molecular Weight:
253.2512
MDL Number:
MFCD02682202
IUPAC Name:
3-hydroxy-5-[(2-methylpropan-2-yl)oxycarbonylamino]benzoic acid
InChI:
InChI=1S/C12H15NO5/c1-12(2,3)18-11(17)13-8-4-7(10(15)16)5-9(14)6-8/h4-6,14H,1-3H3,(H,13,17)(H,15,16)
InChI Key:
KSTCXQVSGVVIAO-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)Nc1cc(O)cc(c1)C(=O)O
Properties
Complexity:
323  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
253.095g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
253.254g/mol
Monoisotopic Mass:
253.095g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
95.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties