200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 137469-84-2
137469-84-2 | 4H-1,2,3,5-Benzotetrazepin-4-one, 3,5-dihydro-3,5-dimethyl-
CAS No: 137469-84-2 Catalog No: AG0013BQ MDL No:
Product Description
Catalog Number:
AG0013BQ
Chemical Name:
4H-1,2,3,5-Benzotetrazepin-4-one, 3,5-dihydro-3,5-dimethyl-
CAS Number:
137469-84-2
Molecular Formula:
C9H10N4O
Molecular Weight:
190.2019
IUPAC Name:
3,5-dimethyl-1,2,3,5-benzotetrazepin-4-one
InChI:
InChI=1S/C9H10N4O/c1-12-8-6-4-3-5-7(8)10-11-13(2)9(12)14/h3-6H,1-2H3
InChI Key:
AQNZTEAEKUPDTB-UHFFFAOYSA-N
SMILES:
Cn1nnc2c(n(c1=O)C)cccc2
Properties
Complexity:
266
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.085g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
190.206g/mol
Monoisotopic Mass:
190.085g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
48.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.