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Home Other Building Blocks 4-Boc-1,2,3,5-tetrahydrobenzo[e][1,4]diazepine

4-Boc-1,2,3,5-tetrahydrobenzo[e][1,4]diazepine

CAS No.:
195983-63-2
Catalog Number:
AG003873
Molecular Formula:
C14H20N2O2
Molecular Weight:
248.3208
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
97%
1 week
United States
$160
- +
1g
97%
1 week
United States
$344
- +
5g
97%
1 week
United States
$956
- +
Product Description
Catalog Number:
AG003873
Chemical Name:
4-Boc-1,2,3,5-tetrahydrobenzo[e][1,4]diazepine
CAS Number:
195983-63-2
Molecular Formula:
C14H20N2O2
Molecular Weight:
248.3208
MDL Number:
MFCD06245546
IUPAC Name:
tert-butyl 1,2,3,5-tetrahydro-1,4-benzodiazepine-4-carboxylate
InChI:
InChI=1S/C14H20N2O2/c1-14(2,3)18-13(17)16-9-8-15-12-7-5-4-6-11(12)10-16/h4-7,15H,8-10H2,1-3H3
InChI Key:
BVENZEAGNIYZSY-UHFFFAOYSA-N
SMILES:
O=C(N1CCNc2c(C1)cccc2)OC(C)(C)C
Properties
Complexity:
299  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.152g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
248.326g/mol
Monoisotopic Mass:
248.152g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Literature
Title Journal
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Properties