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Home Nitros 2-Benzyl-6-nitro-1,2,3,4-tetrahydroisoquinoline

2-Benzyl-6-nitro-1,2,3,4-tetrahydroisoquinoline

CAS No.:
208589-95-1
Catalog Number:
AG002JSA
Molecular Formula:
C16H16N2O2
Molecular Weight:
268.3104
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$126
- +
250mg
95%
In Stock USA
United States
$221
- +
1g
95%
In Stock USA
United States
$357
- +
Product Description
Catalog Number:
AG002JSA
Chemical Name:
2-Benzyl-6-nitro-1,2,3,4-tetrahydroisoquinoline
CAS Number:
208589-95-1
Molecular Formula:
C16H16N2O2
Molecular Weight:
268.3104
MDL Number:
MFCD10696109
IUPAC Name:
2-benzyl-6-nitro-3,4-dihydro-1H-isoquinoline
InChI:
InChI=1S/C16H16N2O2/c19-18(20)16-7-6-15-12-17(9-8-14(15)10-16)11-13-4-2-1-3-5-13/h1-7,10H,8-9,11-12H2
InChI Key:
ZKVVNEZVGMWFCN-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc2c(c1)CCN(C2)Cc1ccccc1
Properties
Complexity:
336  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
268.121g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
268.316g/mol
Monoisotopic Mass:
268.121g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
49.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  
Properties