| CAS Number | 1094813-04-3 |
| Catalog Number | AG01BXRZ |
| Chemical Name | 1-N-methyl-1-n-propylbenzene-1,2-diamine |
| IUPAC Name | 2-N-methyl-2-N-propylbenzene-1,2-diamine |
| InChI | InChI=1S/C10H16N2/c1-3-8-12(2)10-7-5-4-6-9(10)11/h4-7H,3,8,11H2,1-2H3 |
| InChI Key | AQKCEEDYFUOWCU-UHFFFAOYSA-N |
| MDL Number | MFCD11627041 |
| Molecular Formula | C10H16N2 |
| Molecular Weight | 164.2474 |
| SMILES | CCCN(C1=C(N)C=CC=C1)C |
| Synonyms | N1-methyl-N1-propylbenzene-1,2-diamine,
1094813-04-3,
SCHEMBL3542027,
ZINC37097961,
AKOS009412766,
Z2694742637,
|
| Complexity | 125 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 164.131g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 164.252g/mol |
| Monoisotopic Mass | 164.131g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 29.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number