Home Halogens 1-(4-bromophenyl)-2-methyl-2-nitropropan-1-ol

1-(4-bromophenyl)-2-methyl-2-nitropropan-1-ol

CAS No.:
33682-88-1
Catalog Number:
AG01A5QF
Molecular Formula:
C10H12BrNO3
Molecular Weight:
274.1112
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Product Description
Catalog Number:
AG01A5QF
Chemical Name:
1-(4-bromophenyl)-2-methyl-2-nitropropan-1-ol
CAS Number:
33682-88-1
Molecular Formula:
C10H12BrNO3
Molecular Weight:
274.1112
MDL Number:
MFCD25371614
IUPAC Name:
1-(4-bromophenyl)-2-methyl-2-nitropropan-1-ol
InChI:
InChI=1S/C10H12BrNO3/c1-10(2,12(14)15)9(13)7-3-5-8(11)6-4-7/h3-6,9,13H,1-2H3
InChI Key:
QVLHYPHMTPDZEP-UHFFFAOYSA-N
SMILES:
OC(C([N+](=O)[O-])(C)C)c1ccc(cc1)Br
Properties
Complexity:
231  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
273g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
274.114g/mol
Monoisotopic Mass:
273g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties