Home Carbonyls 2-(5-(1-((tert-Butoxycarbonyl)amino)ethyl)-1H-1,2,4-triazol-3-yl)acetic acid

2-(5-(1-((tert-Butoxycarbonyl)amino)ethyl)-1H-1,2,4-triazol-3-yl)acetic acid

CAS No.:
938459-15-5
Catalog Number:
AG006CKK
Molecular Formula:
C11H18N4O4
Molecular Weight:
270.2850
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$96
- +
5g
95%
In Stock USA
United States
$216
- +
10g
95%
In Stock USA
United States
$343
- +
Product Description
Catalog Number:
AG006CKK
Chemical Name:
2-(5-(1-((tert-Butoxycarbonyl)amino)ethyl)-1H-1,2,4-triazol-3-yl)acetic acid
CAS Number:
938459-15-5
Molecular Formula:
C11H18N4O4
Molecular Weight:
270.2850
MDL Number:
MFCD20502953
IUPAC Name:
2-[3-[1-[(2-methylpropan-2-yl)oxycarbonylamino]ethyl]-1H-1,2,4-triazol-5-yl]acetic acid
InChI:
InChI=1S/C11H18N4O4/c1-6(12-10(18)19-11(2,3)4)9-13-7(14-15-9)5-8(16)17/h6H,5H2,1-4H3,(H,12,18)(H,16,17)(H,13,14,15)
InChI Key:
FADRJUMYOZQSFZ-UHFFFAOYSA-N
SMILES:
CC(c1nnc([nH]1)CC(=O)O)NC(=O)OC(C)(C)C
Properties
Complexity:
342  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
270.133g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
270.289g/mol
Monoisotopic Mass:
270.133g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
117A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4  
Properties