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Home > Nitro Compounds > 89687-32-1
89687-32-1 | 1H-Azepin-2-ol, hexahydro-1-nitroso-
CAS No: 89687-32-1 Catalog No: AG0042XK MDL No:
Product Description
Catalog Number:
AG0042XK
Chemical Name:
1H-Azepin-2-ol, hexahydro-1-nitroso-
CAS Number:
89687-32-1
Molecular Formula:
C6H12N2O2
Molecular Weight:
144.1717
IUPAC Name:
1-nitrosoazepan-2-ol
InChI:
InChI=1S/C6H12N2O2/c9-6-4-2-1-3-5-8(6)7-10/h6,9H,1-5H2
InChI Key:
DFVQZMGKZKJORQ-UHFFFAOYSA-N
SMILES:
O=NN1CCCCCC1O
Properties
Complexity:
118
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
144.09g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
144.174g/mol
Monoisotopic Mass:
144.09g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
52.9A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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