200,000+ products from a single source!
sales@angenechem.com
1323314-31-3 | 3-(isocyanatomethyl)-5-methyl-1,2-oxazole
CAS No: 1323314-31-3 Catalog No: AG01A01Y MDL No:MFCD18269768
Product Description
Catalog Number:
AG01A01Y
Chemical Name:
3-(isocyanatomethyl)-5-methyl-1,2-oxazole
CAS Number:
1323314-31-3
Molecular Formula:
C6H6N2O2
Molecular Weight:
138.1240
MDL Number:
MFCD18269768
IUPAC Name:
3-(isocyanatomethyl)-5-methyl-1,2-oxazole
InChI:
InChI=1S/C6H6N2O2/c1-5-2-6(8-10-5)3-7-4-9/h2H,3H2,1H3
InChI Key:
HJBKIDCQPTWJOH-UHFFFAOYSA-N
SMILES:
Cc1cc(no1)CN=C=O
Properties
Complexity:
154
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
138.043g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
138.126g/mol
Monoisotopic Mass:
138.043g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
55.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.