Home Other Building Blocks 4-Boc-7,8-dimethoxy-2,3,4,5-tetrahydro-1h-benzo[e][1,4]diazepine

4-Boc-7,8-dimethoxy-2,3,4,5-tetrahydro-1h-benzo[e][1,4]diazepine

CAS No.:
886364-26-7
Catalog Number:
AG004AF1
Molecular Formula:
C16H24N2O4
Molecular Weight:
308.3728
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
1 week
United States
$305
- +
5g
97%
1 week
United States
$953
- +
Product Description
Catalog Number:
AG004AF1
Chemical Name:
4-Boc-7,8-dimethoxy-2,3,4,5-tetrahydro-1h-benzo[e][1,4]diazepine
CAS Number:
886364-26-7
Molecular Formula:
C16H24N2O4
Molecular Weight:
308.3728
MDL Number:
MFCD07369863
IUPAC Name:
tert-butyl 7,8-dimethoxy-1,2,3,5-tetrahydro-1,4-benzodiazepine-4-carboxylate
InChI:
InChI=1S/C16H24N2O4/c1-16(2,3)22-15(19)18-7-6-17-12-9-14(21-5)13(20-4)8-11(12)10-18/h8-9,17H,6-7,10H2,1-5H3
InChI Key:
XNSPGFQVDOLCAR-UHFFFAOYSA-N
SMILES:
COc1cc2CN(CCNc2cc1OC)C(=O)OC(C)(C)C
Properties
Complexity:
383  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
308.174g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
308.378g/mol
Monoisotopic Mass:
308.174g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
60A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties