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Home > Nitro Compounds > 1501923-09-6
1501923-09-6 | 2,2-dimethyl-3-(4-nitrophenyl)cyclobutan-1-ol
CAS No: 1501923-09-6 Catalog No: AG01C1SF MDL No:MFCD24103446
Product Description
Catalog Number:
AG01C1SF
Chemical Name:
2,2-dimethyl-3-(4-nitrophenyl)cyclobutan-1-ol
CAS Number:
1501923-09-6
Molecular Formula:
C12H15NO3
Molecular Weight:
221.2524
MDL Number:
MFCD24103446
IUPAC Name:
2,2-dimethyl-3-(4-nitrophenyl)cyclobutan-1-ol
InChI:
InChI=1S/C12H15NO3/c1-12(2)10(7-11(12)14)8-3-5-9(6-4-8)13(15)16/h3-6,10-11,14H,7H2,1-2H3
InChI Key:
ODRIPCLHMNNNND-UHFFFAOYSA-N
SMILES:
OC1CC(C1(C)C)c1ccc(cc1)[N+](=O)[O-]
Properties
Complexity:
277
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.105g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
221.256g/mol
Monoisotopic Mass:
221.105g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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