Name: Name:2H-1,5-Benzodioxepin-7-methanamine, 3,4-dihydro-
Brand: Angene
SKU: AG002NCU
Rating: 90 (10 reviews)

2H-1,5-Benzodioxepin-7-methanamine, 3,4-dihydro-

CAS No.:

23475-00-5

Catalog Number:

AG002NCU

Molecular Formula:

C10H13NO2

Molecular Weight:

179.2157

Catalog Number:

AG002NCU

Chemical Name:

2H-1,5-Benzodioxepin-7-methanamine, 3,4-dihydro-

CAS Number:

23475-00-5

Molecular Formula:

C10H13NO2

Molecular Weight:

179.2157

MDL Number:

MFCD02682040

IUPAC Name:

3,4-dihydro-2H-1,5-benzodioxepin-7-ylmethanamine

InChI:

InChI=1S/C10H13NO2/c11-7-8-2-3-9-10(6-8)13-5-1-4-12-9/h2-3,6H,1,4-5,7,11H2

InChI Key:

MCHQABHXBPYZCT-UHFFFAOYSA-N

SMILES:

NCc1ccc2c(c1)OCCCO2

Complexity:

163

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

179.095g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

179.219g/mol

Monoisotopic Mass:

179.095g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

44.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.1