Home Carbonyls tert-Butyl N-[(1H-1,2,3-benzotriazol-1-yl({[(tert-butoxy)carbonyl]imino})methyl]carbamate

tert-Butyl N-[(1H-1,2,3-benzotriazol-1-yl({[(tert-butoxy)carbonyl]imino})methyl]carbamate

CAS No.:
383910-37-0
Catalog Number:
AG01F36G
Molecular Formula:
C17H23N5O4
Molecular Weight:
361.3956
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
50mg
tech
1 week
United States
$309
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Product Description
Catalog Number:
AG01F36G
Chemical Name:
tert-Butyl N-[(1H-1,2,3-benzotriazol-1-yl({[(tert-butoxy)carbonyl]imino})methyl]carbamate
CAS Number:
383910-37-0
Molecular Formula:
C17H23N5O4
Molecular Weight:
361.3956
MDL Number:
MFCD30530139
IUPAC Name:
tert-butyl (NE)-N-[benzotriazol-1-yl-[(2-methylpropan-2-yl)oxycarbonylamino]methylidene]carbamate
InChI:
InChI=1S/C17H23N5O4/c1-16(2,3)25-14(23)18-13(19-15(24)26-17(4,5)6)22-12-10-8-7-9-11(12)20-21-22/h7-10H,1-6H3,(H,18,19,23,24)
InChI Key:
JEEPGQDKVCACHZ-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)N/C(=N/C(=O)OC(C)(C)C)/n1nnc2c1cccc2
Properties
Complexity:
565  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1  
Exact Mass:
361.175g/mol
Formal Charge:
0
Heavy Atom Count:
26  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
361.402g/mol
Monoisotopic Mass:
361.175g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
108A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4  
Properties