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Home Carbonyls Methyl 3-([(tert-butoxy)carbonyl]amino)benzoate

Methyl 3-([(tert-butoxy)carbonyl]amino)benzoate

CAS No.:
161111-23-5
Catalog Number:
AG00HYND
Molecular Formula:
C13H17NO4
Molecular Weight:
251.2784
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$438
- +
5g
98%
In Stock USA
United States
$1500
- +
10g
98%
In Stock USA
United States
$2000
- +
Product Description
Catalog Number:
AG00HYND
Chemical Name:
Methyl 3-([(tert-butoxy)carbonyl]amino)benzoate
CAS Number:
161111-23-5
Molecular Formula:
C13H17NO4
Molecular Weight:
251.2784
MDL Number:
MFCD12488155
IUPAC Name:
methyl 3-[(2-methylpropan-2-yl)oxycarbonylamino]benzoate
InChI:
InChI=1S/C13H17NO4/c1-13(2,3)18-12(16)14-10-7-5-6-9(8-10)11(15)17-4/h5-8H,1-4H3,(H,14,16)
InChI Key:
BLGMHLRIKCHNEM-UHFFFAOYSA-N
SMILES:
COC(=O)c1cccc(c1)NC(=O)OC(C)(C)C
Properties
Complexity:
309  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
251.116g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
251.282g/mol
Monoisotopic Mass:
251.116g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
64.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties