200,000+ products from a single source!
sales@angenechem.com
104029-70-1 | 2-Benzoxazolemethanol, a-(3-methoxyphenyl)-,methylcarbamate (ester) (9CI)
CAS No: 104029-70-1 Catalog No: AG00855G MDL No:
Product Description
Catalog Number:
AG00855G
Chemical Name:
2-Benzoxazolemethanol, a-(3-methoxyphenyl)-,methylcarbamate (ester) (9CI)
CAS Number:
104029-70-1
Molecular Formula:
C17H16N2O4
Molecular Weight:
312.3199
IUPAC Name:
[1,3-benzoxazol-2-yl-(3-methoxyphenyl)methyl] N-methylcarbamate
InChI:
InChI=1S/C17H16N2O4/c1-18-17(20)23-15(11-6-5-7-12(10-11)21-2)16-19-13-8-3-4-9-14(13)22-16/h3-10,15H,1-2H3,(H,18,20)
InChI Key:
KVHMBHAQEVMLQP-UHFFFAOYSA-N
SMILES:
CNC(=O)OC(c1nc2c(o1)cccc2)c1cccc(c1)OC
Properties
Complexity:
406
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
312.111g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
312.325g/mol
Monoisotopic Mass:
312.111g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
73.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.