| CAS Number | 1217129-50-4 |
| Catalog Number | AG00J2CM |
| Chemical Name | [4-(2-propyn-1-yloxy)phenyl]amine hydrochloride |
| IUPAC Name | 4-prop-2-ynoxyaniline;hydrochloride |
| InChI | InChI=1S/C9H9NO.ClH/c1-2-7-11-9-5-3-8(10)4-6-9;/h1,3-6H,7,10H2;1H |
| InChI Key | SVOMGBJDHWHLGE-UHFFFAOYSA-N |
| MDL Number | MFCD18434594 |
| Molecular Formula | C9H10ClNO |
| Molecular Weight | 183.6348 |
| SMILES | C(COC1=CC=C(N)C=C1)#C.Cl |
| Synonyms | [4-(prop-2-yn-1-yloxy)phenyl]amine hydrochloride,
1217129-50-4,
[4-(2-Propyn-1-yloxy)phenyl]amine hydrochloride,
F2158-1548,
SCHEMBL19742209,
4-(2-Propyn-1-yloxy)benzenamine,
ZX-CM009044,
MFCD18434594,
AKOS005063172,
MCULE-1680099594,
L-4499,
4-(2-PROPYN-1-YLOXY)ANILINE HYDROCHLORIDE,
4039862-25G,
26557-78-8,
|
| Complexity | 150 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 183.045g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 183.635g/mol |
| Monoisotopic Mass | 183.045g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 35.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number