Name: Name:3-bromo-5-methyl-6-nitro-1-tritylindazole
Brand: Angene
SKU: AG01DGT8
Rating: 90 (10 reviews)

3-bromo-5-methyl-6-nitro-1-tritylindazole

CAS No.:

1695537-77-9

Catalog Number:

AG01DGT8

Molecular Formula:

C27H20BrN3O2

Molecular Weight:

498.3706

Catalog Number:

AG01DGT8

Chemical Name:

3-bromo-5-methyl-6-nitro-1-tritylindazole

CAS Number:

1695537-77-9

Molecular Formula:

C27H20BrN3O2

Molecular Weight:

498.3706

MDL Number:

MFCD29059373

IUPAC Name:

3-bromo-5-methyl-6-nitro-1-tritylindazole

InChI:

InChI=1S/C27H20BrN3O2/c1-19-17-23-25(18-24(19)31(32)33)30(29-26(23)28)27(20-11-5-2-6-12-20,21-13-7-3-8-14-21)22-15-9-4-10-16-22/h2-18H,1H3

InChI Key:

XPGCHKBLQOGPCU-UHFFFAOYSA-N

SMILES:

[O-][N+](=O)c1cc2c(cc1C)c(nn2C(c1ccccc1)(c1ccccc1)c1ccccc1)Br

Complexity:

621

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

497.074g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

498.38g/mol

Monoisotopic Mass:

497.074g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

63.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

7.6