| CAS Number | 441801-35-0 |
| Catalog Number | AG00IU28(AGN-PC-0WAZ64) |
| Chemical Name | 3-Bromo-1H-indole-2-carbohydrazide |
| IUPAC Name | 3-bromo-1H-indole-2-carbohydrazide |
| InChI | InChI=1S/C9H8BrN3O/c10-7-5-3-1-2-4-6(5)12-8(7)9(14)13-11/h1-4,12H,11H2,(H,13,14) |
| InChI Key | KGKOTYYYBJBGOU-UHFFFAOYSA-N |
| MDL Number | MFCD08444014 |
| Molecular Formula | C9H8BrN3O |
| Molecular Weight | 254.0833 |
| SMILES | C1C=C2C(=CC=1)NC(C(=O)NN)=C2Br |
| Synonyms | 3-Bromo-1H-indole-2-carbohydrazide,
441801-35-0,
3-bromoindole-2-carbohydrazide,
bromoindolecarbohydrazide,
SCHEMBL7675599,
CTK7E9848,
KS-000024AB,
ZINC8729878,
MFCD08444014,
SBB056396,
AKOS005072155,
DA-0869,
MCULE-8078958402,
RP14422,
AJ-58883,
TR-064510,
ST50950123,
|
| Complexity | 236 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 252.985g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 254.087g/mol |
| Monoisotopic Mass | 252.985g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 70.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number