Name: Name:4-amino-6-chloro-3,4-dihydro-2H-1lambda6-benzothiopyran-1,1-dione
Brand: Angene
SKU: AG019ZUQ
Rating: 90 (10 reviews)

4-amino-6-chloro-3,4-dihydro-2H-1lambda6-benzothiopyran-1,1-dione

CAS No.:

1039912-70-3

Catalog Number:

AG019ZUQ

Molecular Formula:

C9H10ClNO2S

Molecular Weight:

231.6992

Catalog Number:

AG019ZUQ

Chemical Name:

4-amino-6-chloro-3,4-dihydro-2H-1lambda6-benzothiopyran-1,1-dione

CAS Number:

1039912-70-3

Molecular Formula:

C9H10ClNO2S

Molecular Weight:

231.6992

MDL Number:

MFCD11190750

IUPAC Name:

6-chloro-1,1-dioxo-3,4-dihydro-2H-thiochromen-4-amine

InChI:

InChI=1S/C9H10ClNO2S/c10-6-1-2-9-7(5-6)8(11)3-4-14(9,12)13/h1-2,5,8H,3-4,11H2

InChI Key:

RCXZIISFWJVMFA-UHFFFAOYSA-N

SMILES:

Clc1ccc2c(c1)C(N)CCS2(=O)=O

Complexity:

311

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

231.012g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

231.694g/mol

Monoisotopic Mass:

231.012g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

68.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.8