| CAS Number | 77369-59-6 |
| Catalog Number | AG00G33U(AGN-PC-0KL7BH) |
| Chemical Name | 4-Chlorobut-2-yn-1-amine hydrochloride |
| IUPAC Name | 4-chlorobut-2-yn-1-amine;hydrochloride |
| InChI | InChI=1S/C4H6ClN.ClH/c5-3-1-2-4-6;/h3-4,6H2;1H |
| InChI Key | HZVTZSFWPLLBRF-UHFFFAOYSA-N |
| MDL Number | MFCD00236918 |
| Molecular Formula | C4H7Cl2N |
| Molecular Weight | 140.0111 |
| SMILES | Cl.NCC#CCCl |
| Synonyms | 4-chlorobut-2-yn-1-amine Hydrochloride,
77369-59-6,
1-AMINO-4-CHLORO-2-BUTYNE HCL,
1-amino-4-chloro-2-butyne hydrochloride,
AC1MDSNI,
C4H6ClN.HCl,
CTK7E1823,
DTXSID30383550,
HZVTZSFWPLLBRF-UHFFFAOYSA-N,
ZX-AT020267,
5604AH,
MFCD00236918,
OR28056,
4-chlorobut-2-yn-1-amine,hydrochloride,
FT-0757553,
1-Amino-4-chloro-2-butyne hydrochloride, 90%,
CID2795124,
|
| Complexity | 76 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 138.996g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 7 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 140.007g/mol |
| Monoisotopic Mass | 138.996g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 26A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
| Symbol: |   |
|
Hazard Class
|
9
|
|
Hazard statements
|
H302-H400
|
|
Packing Group
|
Ⅲ
|
|
Precautionary statements
|
P273
|
|
UN Code
|
UN 3077
|
Certificate of Analysis
Lot Number