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Home Carbonyls Methyl 2-((tert-butoxycarbonyl)amino)-3-(1-methyl-1H-imidazol-5-yl)propanoate

Methyl 2-((tert-butoxycarbonyl)amino)-3-(1-methyl-1H-imidazol-5-yl)propanoate

CAS No.:
1207887-42-0
Catalog Number:
AG00HFR8
Molecular Formula:
C13H21N3O4
Molecular Weight:
283.3235
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$200
- +
250mg
95%
In Stock USA
United States
$368
- +
1g
95%
In Stock USA
United States
$735
- +
5g
95%
In Stock USA
United States
$2205
- +
Product Description
Catalog Number:
AG00HFR8
Chemical Name:
Methyl 2-((tert-butoxycarbonyl)amino)-3-(1-methyl-1H-imidazol-5-yl)propanoate
CAS Number:
1207887-42-0
Molecular Formula:
C13H21N3O4
Molecular Weight:
283.3235
MDL Number:
MFCD24532498
IUPAC Name:
methyl 3-(3-methylimidazol-4-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate
InChI:
InChI=1S/C13H21N3O4/c1-13(2,3)20-12(18)15-10(11(17)19-5)6-9-7-14-8-16(9)4/h7-8,10H,6H2,1-5H3,(H,15,18)
InChI Key:
KEWJAQUOHBEHGW-UHFFFAOYSA-N
SMILES:
COC(=O)C(Cc1cncn1C)NC(=O)OC(C)(C)C
Properties
Complexity:
354  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
283.153g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
283.328g/mol
Monoisotopic Mass:
283.153g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
82.4A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties