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Home > Nitro Compounds > 75775-41-6
75775-41-6 | Phenol,3-(1-methylethyl)-2-nitroso-
CAS No: 75775-41-6 Catalog No: AG005IER MDL No:MFCD27957708
Product Description
Catalog Number:
AG005IER
Chemical Name:
Phenol,3-(1-methylethyl)-2-nitroso-
CAS Number:
75775-41-6
Molecular Formula:
C9H11NO2
Molecular Weight:
165.1891
MDL Number:
MFCD27957708
IUPAC Name:
2-nitroso-3-propan-2-ylphenol
InChI:
InChI=1S/C9H11NO2/c1-6(2)7-4-3-5-8(11)9(7)10-12/h3-6,11H,1-2H3
InChI Key:
UARALVGEUYJOJB-UHFFFAOYSA-N
SMILES:
O=Nc1c(O)cccc1C(C)C
Properties
Complexity:
159
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
165.079g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
165.192g/mol
Monoisotopic Mass:
165.079g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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