Home Nitros (1S)-4-nitro-2,3-dihydro-1H-inden-1-ol

(1S)-4-nitro-2,3-dihydro-1H-inden-1-ol

CAS No.:
2058059-32-6
Catalog Number:
AG01EMR0
Molecular Formula:
C9H9NO3
Molecular Weight:
179.1727
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Product Description
Catalog Number:
AG01EMR0
Chemical Name:
(1S)-4-nitro-2,3-dihydro-1H-inden-1-ol
CAS Number:
2058059-32-6
Molecular Formula:
C9H9NO3
Molecular Weight:
179.1727
MDL Number:
MFCD31665490
IUPAC Name:
(1S)-4-nitro-2,3-dihydro-1H-inden-1-ol
InChI:
InChI=1S/C9H9NO3/c11-9-5-4-6-7(9)2-1-3-8(6)10(12)13/h1-3,9,11H,4-5H2/t9-/m0/s1
InChI Key:
LZMRRYRIKGREQH-VIFPVBQESA-N
SMILES:
O[C@H]1CCc2c1cccc2[N+](=O)[O-]
Properties
Complexity:
213  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
179.058g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
179.175g/mol
Monoisotopic Mass:
179.058g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties