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89101-51-9 | Diazene, [1-[[bis(acetyloxy)boryl]phenylhydrazono]ethyl]phenyl-
CAS No: 89101-51-9 Catalog No: AG00409Y MDL No:
Product Description
Catalog Number:
AG00409Y
Chemical Name:
Diazene, [1-[[bis(acetyloxy)boryl]phenylhydrazono]ethyl]phenyl-
CAS Number:
89101-51-9
Molecular Formula:
C18H19BN4O4
Molecular Weight:
366.1789
IUPAC Name:
[acetyloxy-(N-(1-phenyldiazenylethylideneamino)anilino)boranyl] acetate
InChI:
InChI=1S/C18H19BN4O4/c1-14(20-21-17-10-6-4-7-11-17)22-23(18-12-8-5-9-13-18)19(26-15(2)24)27-16(3)25/h4-13H,1-3H3
InChI Key:
RTURKHUFWHKILR-UHFFFAOYSA-N
SMILES:
CC(=NN(c1ccccc1)B(OC(=O)C)OC(=O)C)N=Nc1ccccc1
Properties
Complexity:
542
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
366.15g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
366.184g/mol
Monoisotopic Mass:
366.15g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
92.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
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