| CAS Number | 1007500-73-3 |
| Catalog Number | AG00JFQX(AGN-PC-0WBCBY) |
| Chemical Name | [1-(1-ethyl-1H-pyrazol-4-yl)ethyl]amine |
| IUPAC Name | 1-(1-ethylpyrazol-4-yl)ethanamine |
| InChI | InChI=1S/C7H13N3/c1-3-10-5-7(4-9-10)6(2)8/h4-6H,3,8H2,1-2H3 |
| InChI Key | FVEXVBVWVVFGAT-UHFFFAOYSA-N |
| MDL Number | MFCD08700765 |
| Molecular Formula | C7H13N3 |
| Molecular Weight | 139.1982 |
| SMILES | CCN1N=CC(C(N)C)=C1 |
| Synonyms | 1-(1-ethyl-1H-pyrazol-4-yl)ethanamine,
1007500-73-3,
[1-(1-ethyl-1H-pyrazol-4-yl)ethyl]amine,
1-(1-ethyl-1H-pyrazol-4-yl)ethan-1-amine,
1-(1-ethylpyrazol-4-yl)ethylamine,
AC1Q310I,
CTK6F0985,
MFCD08700765,
SBB025948,
STK352876,
AKOS003672586,
AKOS016345119,
MCULE-4393535467,
ST45134248,
EN300-89111,
F8885-1851,
1-(1-ethylpyrazol-4-yl)ethanamine,
|
| Complexity | 105 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 139.111g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 139.202g/mol |
| Monoisotopic Mass | 139.111g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 43.8A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number