Name: Name:(9-chloro-3,4-dihydro-2H-1,5-benzodioxepin-7-yl)methanol
Brand: Angene
SKU: AG00IDMK
Rating: 90 (10 reviews)

(9-chloro-3,4-dihydro-2H-1,5-benzodioxepin-7-yl)methanol

CAS No.:

852956-43-5

Catalog Number:

AG00IDMK

Molecular Formula:

C10H11ClO3

Molecular Weight:

214.6455

Catalog Number:

AG00IDMK

Chemical Name:

(9-chloro-3,4-dihydro-2H-1,5-benzodioxepin-7-yl)methanol

CAS Number:

852956-43-5

Molecular Formula:

C10H11ClO3

Molecular Weight:

214.6455

MDL Number:

MFCD06655730

IUPAC Name:

(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methanol

InChI:

InChI=1S/C10H11ClO3/c11-8-4-7(6-12)5-9-10(8)14-3-1-2-13-9/h4-5,12H,1-3,6H2

InChI Key:

LMOWJYPRQLIBBN-UHFFFAOYSA-N

SMILES:

OCc1cc2OCCCOc2c(c1)Cl

Complexity:

188

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

214.04g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

214.645g/mol

Monoisotopic Mass:

214.04g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

38.7A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.7