Home Carbonyls 4-[4-({[(tert-butoxy)carbonyl]amino}methyl)phenyl]benzoic acid

4-[4-({[(tert-butoxy)carbonyl]amino}methyl)phenyl]benzoic acid

CAS No.:
193152-00-0
Catalog Number:
AG01EKM1
Molecular Formula:
C19H21NO4
Molecular Weight:
327.3743
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01EKM1
Chemical Name:
4-[4-({[(tert-butoxy)carbonyl]amino}methyl)phenyl]benzoic acid
CAS Number:
193152-00-0
Molecular Formula:
C19H21NO4
Molecular Weight:
327.3743
MDL Number:
MFCD29917512
IUPAC Name:
4-[4-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]phenyl]benzoic acid
InChI:
InChI=1S/C19H21NO4/c1-19(2,3)24-18(23)20-12-13-4-6-14(7-5-13)15-8-10-16(11-9-15)17(21)22/h4-11H,12H2,1-3H3,(H,20,23)(H,21,22)
InChI Key:
UCYQVIQLHDTNDX-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)NCc1ccc(cc1)c1ccc(cc1)C(=O)O
Properties
Complexity:
427  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
327.147g/mol
Formal Charge:
0
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
327.38g/mol
Monoisotopic Mass:
327.147g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6  
Properties