Home Carboxys tert-Butyl 6-hydroxy-1,4-diazepane-1-carboxylate

tert-Butyl 6-hydroxy-1,4-diazepane-1-carboxylate

CAS No.:
956317-40-1
Catalog Number:
AG00IJ9Q
Molecular Formula:
C10H20N2O3
Molecular Weight:
216.2774
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
1 week
United States
$541
- +
Product Description
Catalog Number:
AG00IJ9Q
Chemical Name:
tert-Butyl 6-hydroxy-1,4-diazepane-1-carboxylate
CAS Number:
956317-40-1
Molecular Formula:
C10H20N2O3
Molecular Weight:
216.2774
MDL Number:
MFCD18074501
IUPAC Name:
tert-butyl 6-hydroxy-1,4-diazepane-1-carboxylate
InChI:
InChI=1S/C10H20N2O3/c1-10(2,3)15-9(14)12-5-4-11-6-8(13)7-12/h8,11,13H,4-7H2,1-3H3
InChI Key:
GBVLDEOLVSGEJQ-UHFFFAOYSA-N
SMILES:
OC1CNCCN(C1)C(=O)OC(C)(C)C
Properties
Complexity:
225  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.147g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
216.281g/mol
Monoisotopic Mass:
216.147g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
61.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2  
Properties