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81541-84-6

81541-84-6 | 1-Nonanol, 9-nitro-

CAS No: 81541-84-6 Catalog No: AG00590B MDL No:

Product Description

Catalog Number:
AG00590B
Chemical Name:
1-Nonanol, 9-nitro-
CAS Number:
81541-84-6
Molecular Formula:
C9H19NO3
Molecular Weight:
189.2521
IUPAC Name:
9-nitrononan-1-ol
InChI:
InChI=1S/C9H19NO3/c11-9-7-5-3-1-2-4-6-8-10(12)13/h11H,1-9H2
InChI Key:
SLLKICYJHPXTNM-UHFFFAOYSA-N
SMILES:
OCCCCCCCCC[N+](=O)[O-]

Properties

Complexity:
123  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.136g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
189.255g/mol
Monoisotopic Mass:
189.136g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  

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