200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 201224-94-4
201224-94-4 | Pentane, 2-isothiocyanato-
CAS No: 201224-94-4 Catalog No: AG002DAF MDL No:MFCD00060396
Product Description
Catalog Number:
AG002DAF
Chemical Name:
Pentane, 2-isothiocyanato-
CAS Number:
201224-94-4
Molecular Formula:
C6H11NS
Molecular Weight:
129.2232
MDL Number:
MFCD00060396
IUPAC Name:
2-isothiocyanatopentane
InChI:
InChI=1S/C6H11NS/c1-3-4-6(2)7-5-8/h6H,3-4H2,1-2H3
InChI Key:
SQBOSXLLKLBNSH-UHFFFAOYSA-N
SMILES:
CC(N=C=S)CCC
Properties
Complexity:
94.7
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
129.061g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
129.221g/mol
Monoisotopic Mass:
129.061g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
44.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.