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874470-78-7

874470-78-7 | Spiro[2H-indole-2,2'-[2H]pyran], 1,3-dihydro-1,3,3-trimethyl-5'-nitro-

CAS No: 874470-78-7 Catalog No: AG004KC6 MDL No:

Product Description

Catalog Number:
AG004KC6
Chemical Name:
Spiro[2H-indole-2,2'-[2H]pyran], 1,3-dihydro-1,3,3-trimethyl-5'-nitro-
CAS Number:
874470-78-7
Molecular Formula:
C15H16N2O3
Molecular Weight:
272.2991
IUPAC Name:
1,3,3-trimethyl-5'-nitrospiro[indole-2,2'-pyran]
InChI:
InChI=1S/C15H16N2O3/c1-14(2)12-6-4-5-7-13(12)16(3)15(14)9-8-11(10-20-15)17(18)19/h4-10H,1-3H3
InChI Key:
FTUPZNIRRCOOSC-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)C1=COC2(C=C1)N(C)c1c(C2(C)C)cccc1

Properties

Complexity:
492  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
272.116g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
272.304g/mol
Monoisotopic Mass:
272.116g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
58.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  

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