200,000+ products from a single source!
sales@angenechem.com
152298-09-4 | 2-Benzoxazolemethanethiol
CAS No: 152298-09-4 Catalog No: AG007YMV MDL No:
Product Description
Catalog Number:
AG007YMV
Chemical Name:
2-Benzoxazolemethanethiol
CAS Number:
152298-09-4
Molecular Formula:
C8H7NOS
Molecular Weight:
165.2123
IUPAC Name:
1,3-benzoxazol-2-ylmethanethiol
InChI:
InChI=1S/C8H7NOS/c11-5-8-9-6-3-1-2-4-7(6)10-8/h1-4,11H,5H2
InChI Key:
DOHKESIGQLCYFU-UHFFFAOYSA-N
SMILES:
SCc1nc2c(o1)cccc2
Properties
Complexity:
142
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
165.025g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
165.21g/mol
Monoisotopic Mass:
165.025g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
27A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.