200,000+ products from a single source!
sales@angenechem.com
14372-52-2 | Thiocyanic acid, 2-amino-4-methoxy-6-benzothiazolyl ester
CAS No: 14372-52-2 Catalog No: AG001I9K MDL No:
Product Description
Catalog Number:
AG001I9K
Chemical Name:
Thiocyanic acid, 2-amino-4-methoxy-6-benzothiazolyl ester
CAS Number:
14372-52-2
Molecular Formula:
C9H7N3OS2
Molecular Weight:
237.3014
IUPAC Name:
(2-amino-4-methoxy-1,3-benzothiazol-6-yl) thiocyanate
InChI:
InChI=1S/C9H7N3OS2/c1-13-6-2-5(14-4-10)3-7-8(6)12-9(11)15-7/h2-3H,1H3,(H2,11,12)
InChI Key:
DBOLHUAGUXIJOQ-UHFFFAOYSA-N
SMILES:
N#CSc1cc(OC)c2c(c1)sc(n2)N
Properties
Complexity:
280
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.003g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
237.295g/mol
Monoisotopic Mass:
237.003g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
126A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.