| CAS Number | 1247356-88-2 |
| Catalog Number | AG00HHS0(AGN-PC-0WNOJM) |
| Chemical Name | 2-Bromo-1-N-cyclopropylbenzene-1,4-diamine |
| IUPAC Name | 2-bromo-1-N-cyclopropylbenzene-1,4-diamine |
| InChI | InChI=1S/C9H11BrN2/c10-8-5-6(11)1-4-9(8)12-7-2-3-7/h1,4-5,7,12H,2-3,11H2 |
| InChI Key | UEXLDZWSIIQOHI-UHFFFAOYSA-N |
| MDL Number | MFCD16085324 |
| Molecular Formula | C9H11BrN2 |
| Molecular Weight | 227.1010 |
| SMILES | Nc1ccc(c(c1)Br)NC1CC1 |
| Synonyms | 2-bromo-1-N-cyclopropylbenzene-1,4-diamine,
1247356-88-2,
KM3640,
MFCD16085324,
ZINC43596550,
AKOS010987969,
2-bromo-N1-cyclopropylbenzene-1,4-diamine,
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| Complexity | 159 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 226.011g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 227.105g/mol |
| Monoisotopic Mass | 226.011g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 38A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.5 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number