Name: Name:methyl 5-chloro-2-isothiocyanatobenzoate
Brand: Angene
SKU: AG01AMR9
Rating: 90 (10 reviews)

methyl 5-chloro-2-isothiocyanatobenzoate

CAS No.:

342623-32-9

Catalog Number:

AG01AMR9

Molecular Formula:

Molecular Weight:

Catalog Number:

AG01AMR9

Chemical Name:

methyl 5-chloro-2-isothiocyanatobenzoate

CAS Number:

342623-32-9

MDL Number:

MFCD22557681

IUPAC Name:

methyl 5-chloro-2-isothiocyanatobenzoate

InChI:

InChI=1S/C9H6ClNO2S/c1-13-9(12)7-4-6(10)2-3-8(7)11-5-14/h2-4H,1H3

InChI Key:

DDZWTFVIWHBHTJ-UHFFFAOYSA-N

Complexity:

266

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

226.981g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

227.662g/mol

Monoisotopic Mass:

226.981g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

70.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

4.8