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Home > Nitro Compounds > 866157-34-8
866157-34-8 | 4,4-dimethyl-3-[(4-nitrophenyl)methyl]-1,3-oxazolidine
CAS No: 866157-34-8 Catalog No: AG00IV38 MDL No:MFCD05669967
Product Description
Catalog Number:
AG00IV38
Chemical Name:
4,4-dimethyl-3-[(4-nitrophenyl)methyl]-1,3-oxazolidine
CAS Number:
866157-34-8
Molecular Formula:
C12H16N2O3
Molecular Weight:
236.2670
MDL Number:
MFCD05669967
IUPAC Name:
4,4-dimethyl-3-[(4-nitrophenyl)methyl]-1,3-oxazolidine
InChI:
InChI=1S/C12H16N2O3/c1-12(2)8-17-9-13(12)7-10-3-5-11(6-4-10)14(15)16/h3-6H,7-9H2,1-2H3
InChI Key:
WIECZSHEBAMWJL-UHFFFAOYSA-N
SMILES:
CC1(C)COCN1Cc1ccc(cc1)[N+](=O)[O-]
Properties
Complexity:
280
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.116g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
236.271g/mol
Monoisotopic Mass:
236.116g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
58.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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