Home Carbonyls 4-{[(tert-Butoxy)carbonyl]amino}phenoxyacetic acid

4-{[(tert-Butoxy)carbonyl]amino}phenoxyacetic acid

CAS No.:
188751-52-2
Catalog Number:
AG00I2RD
Molecular Formula:
C13H17NO5
Molecular Weight:
267.2778
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
96%
In Stock USA
United States
$119
- +
5g
96%
In Stock USA
United States
$475
- +
Product Description
Catalog Number:
AG00I2RD
Chemical Name:
4-{[(tert-Butoxy)carbonyl]amino}phenoxyacetic acid
CAS Number:
188751-52-2
Molecular Formula:
C13H17NO5
Molecular Weight:
267.2778
MDL Number:
MFCD14529527
IUPAC Name:
2-[4-[(2-methylpropan-2-yl)oxycarbonylamino]phenoxy]acetic acid
InChI:
InChI=1S/C13H17NO5/c1-13(2,3)19-12(17)14-9-4-6-10(7-5-9)18-8-11(15)16/h4-7H,8H2,1-3H3,(H,14,17)(H,15,16)
InChI Key:
XCVRNGMGBYUWNT-UHFFFAOYSA-N
SMILES:
O=C(Nc1ccc(cc1)OCC(=O)O)OC(C)(C)C
Properties
Complexity:
316  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.111g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
267.281g/mol
Monoisotopic Mass:
267.111g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
84.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties