200,000+ products from a single source!
sales@angenechem.com
68239-68-9 | 5-(acetamido)-2-[2-[[5-(acetamido)-3-ethyl-3H-benzoxazol-2-ylidene]methyl]but-1-enyl]-3-ethylbenzoxazolium perchlorate
CAS No: 68239-68-9 Catalog No: AG00FI3M MDL No:
Product Description
Catalog Number:
AG00FI3M
Chemical Name:
5-(acetamido)-2-[2-[[5-(acetamido)-3-ethyl-3H-benzoxazol-2-ylidene]methyl]but-1-enyl]-3-ethylbenzoxazolium perchlorate
CAS Number:
68239-68-9
IUPAC Name:
N-[(2Z)-2-[(2E)-2-[(5-acetamido-3-ethyl-1,3-benzoxazol-3-ium-2-yl)methylidene]butylidene]-3-ethyl-1,3-benzoxazol-5-yl]acetamide;perchlorate
InChI:
InChI=1S/C27H30N4O4.ClHO4/c1-6-19(13-26-30(7-2)22-15-20(28-17(4)32)9-11-24(22)34-26)14-27-31(8-3)23-16-21(29-18(5)33)10-12-25(23)35-27;2-1(3,4)5/h9-16H,6-8H2,1-5H3,(H-,28,29,32,33);(H,2,3,4,5)
InChI Key:
MATDQNMRZOTTCQ-UHFFFAOYSA-N
EC Number:
269-461-5
Properties
Complexity:
874
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
2
Exact Mass:
574.183g/mol
Formal Charge:
0
Heavy Atom Count:
40
Hydrogen Bond Acceptor Count:
9
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
575.015g/mol
Monoisotopic Mass:
574.183g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
162A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.