200,000+ products from a single source!
sales@angenechem.com
1416354-29-4 | Carbamic acid, N-5-isoxazolyl-, 1,1-dimethylethyl ester
CAS No: 1416354-29-4 Catalog No: AG001GQA MDL No:
Product Description
Catalog Number:
AG001GQA
Chemical Name:
Carbamic acid, N-5-isoxazolyl-, 1,1-dimethylethyl ester
CAS Number:
1416354-29-4
Molecular Formula:
C8H12N2O3
Molecular Weight:
184.1925
IUPAC Name:
tert-butyl N-(1,2-oxazol-5-yl)carbamate
InChI:
InChI=1S/C8H12N2O3/c1-8(2,3)12-7(11)10-6-4-5-9-13-6/h4-5H,1-3H3,(H,10,11)
InChI Key:
FVRWCLQWTZTRJR-UHFFFAOYSA-N
SMILES:
O=C(Nc1ccno1)OC(C)(C)C
Properties
Complexity:
188
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
184.085g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
184.195g/mol
Monoisotopic Mass:
184.085g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
64.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.