Home Carbonyls 2-(tert-Butoxycarbonyl-methyl-amino)-5-methoxy-benzoic acid

2-(tert-Butoxycarbonyl-methyl-amino)-5-methoxy-benzoic acid

CAS No.:
886362-08-9
Catalog Number:
AG0049SG
Molecular Formula:
C14H19NO5
Molecular Weight:
281.3044
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
97%
1 week
United States
$191
- +
1g
97%
1 week
United States
$435
- +
Product Description
Catalog Number:
AG0049SG
Chemical Name:
2-(tert-Butoxycarbonyl-methyl-amino)-5-methoxy-benzoic acid
CAS Number:
886362-08-9
Molecular Formula:
C14H19NO5
Molecular Weight:
281.3044
MDL Number:
MFCD03426357
IUPAC Name:
5-methoxy-2-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]benzoic acid
InChI:
InChI=1S/C14H19NO5/c1-14(2,3)20-13(18)15(4)11-7-6-9(19-5)8-10(11)12(16)17/h6-8H,1-5H3,(H,16,17)
InChI Key:
QGBBFXMCDVMXCH-UHFFFAOYSA-N
SMILES:
COc1ccc(c(c1)C(=O)O)N(C(=O)OC(C)(C)C)C
Properties
Complexity:
363  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
281.126g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
281.308g/mol
Monoisotopic Mass:
281.126g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
76.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties