Home Other Building Blocks trans-1-Methyloctahydro-1,6-naphthyridin-2(1H)-one

trans-1-Methyloctahydro-1,6-naphthyridin-2(1H)-one

CAS No.:
1368347-76-5
Catalog Number:
AG00O69Q
Molecular Formula:
C9H16N2O
Molecular Weight:
168.2361
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
1 week
United States
$637
- +
Product Description
Catalog Number:
AG00O69Q
Chemical Name:
trans-1-Methyloctahydro-1,6-naphthyridin-2(1H)-one
CAS Number:
1368347-76-5
Molecular Formula:
C9H16N2O
Molecular Weight:
168.2361
MDL Number:
MFCD22067641
IUPAC Name:
(4aR,8aR)-1-methyl-3,4,4a,5,6,7,8,8a-octahydro-1,6-naphthyridin-2-one
InChI:
InChI=1S/C9H16N2O/c1-11-8-4-5-10-6-7(8)2-3-9(11)12/h7-8,10H,2-6H2,1H3/t7-,8-/m1/s1
InChI Key:
CXOXGMBPBCDYNB-HTQZYQBOSA-N
SMILES:
O=C1CC[C@H]2[C@H](N1C)CCNC2
Properties
Complexity:
193  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0
Exact Mass:
168.126g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
168.24g/mol
Monoisotopic Mass:
168.126g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2  
Properties