200,000+ products from a single source!
sales@angenechem.com
Home > Indoles and Oxindole > 101831-95-2
101831-95-2 | 1H-Indole,3-[(hexahydro-1H-azepin-1-yl)methyl]-5-nitro-
CAS No: 101831-95-2 Catalog No: AG00H9N3 MDL No:
Product Description
Catalog Number:
AG00H9N3
Chemical Name:
1H-Indole,3-[(hexahydro-1H-azepin-1-yl)methyl]-5-nitro-
CAS Number:
101831-95-2
IUPAC Name:
3-(azepan-1-ylmethyl)-5-nitro-1H-indole
InChI:
InChI=1S/C15H19N3O2/c19-18(20)13-5-6-15-14(9-13)12(10-16-15)11-17-7-3-1-2-4-8-17/h5-6,9-10,16H,1-4,7-8,11H2
InChI Key:
ABHQIYOUVFNBEC-UHFFFAOYSA-N
Properties
Complexity:
337
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
273.148g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
273.336g/mol
Monoisotopic Mass:
273.148g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
64.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.