200,000+ products from a single source!
sales@angenechem.com
Home > Nitro Compounds > 841243-44-5
841243-44-5 | Furan, 2-(1,1-dimethylethyl)-5-nitro-
CAS No: 841243-44-5 Catalog No: AG004PLT MDL No:
Product Description
Catalog Number:
AG004PLT
Chemical Name:
Furan, 2-(1,1-dimethylethyl)-5-nitro-
CAS Number:
841243-44-5
Molecular Formula:
C8H11NO3
Molecular Weight:
169.1778
IUPAC Name:
2-tert-butyl-5-nitrofuran
InChI:
InChI=1S/C8H11NO3/c1-8(2,3)6-4-5-7(12-6)9(10)11/h4-5H,1-3H3
InChI Key:
XLERQSNLKOUOIP-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc(o1)C(C)(C)C
Properties
Complexity:
180
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
169.074g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
169.18g/mol
Monoisotopic Mass:
169.074g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
59A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.