| CAS Number | 214759-19-0 |
| Catalog Number | AG00C1AD(AGN-PC-0WBKGL) |
| Chemical Name | (4-chlorothiophen-2-yl)methanamine |
| IUPAC Name | (4-chlorothiophen-2-yl)methanamine |
| InChI | InChI=1S/C5H6ClNS/c6-4-1-5(2-7)8-3-4/h1,3H,2,7H2 |
| InChI Key | UDLPZWJCNIRBJZ-UHFFFAOYSA-N |
| MDL Number | MFCD18070967 |
| Molecular Formula | C5H6ClNS |
| Molecular Weight | 147.6258 |
| SMILES | NCC1SC=C(Cl)C=1 |
| Synonyms | (4-CHLOROTHIOPHEN-2-YL)METHANAMINE,
214759-19-0,
SCHEMBL6613887,
DTXSID70626918,
2-Thiophenemethanamine, 4-chloro-,
MFCD18070967,
ZINC62709807,
1-(4-Chlorothiophen-2-yl)methanamine,
AKOS016000949,
PB16734,
KS-000003W0,
AK128496,
AS-51241,
AJ-114206,
CS-0053203,
FT-0759685,
C-2568,
|
| Complexity | 78.8 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 146.991g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 8 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 147.62g/mol |
| Monoisotopic Mass | 146.991g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 54.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.1 |
GHS Hazard and Precautionary Statements
| Symbol: |   |
|
Hazard Class
|
8
|
|
Hazard statements
|
H302-H314
|
|
Packing Group
|
Ⅲ
|
|
Precautionary statements
|
P261-P280-P305+P351+P338-P310
|
|
UN Code
|
UN 2735
|
Certificate of Analysis
Lot Number