| CAS Number | 731821-82-2 |
| Catalog Number | AG00635E(AGN-PC-0KG0WY) |
| Chemical Name | 2-(Chloromethyl)indolizine-1-carbonitrile |
| IUPAC Name | 2-(chloromethyl)indolizine-1-carbonitrile |
| InChI | InChI=1S/C10H7ClN2/c11-5-8-7-13-4-2-1-3-10(13)9(8)6-12/h1-4,7H,5H2 |
| InChI Key | QJEGZGGXGQIJLS-UHFFFAOYSA-N |
| MDL Number | MFCD04628566 |
| Molecular Formula | C10H7ClN2 |
| Molecular Weight | 190.6290 |
| SMILES | ClCC1C(C#N)=C2N(C=CC=C2)C=1 |
| Synonyms | 2-(chloromethyl)indolizine-1-carbonitrile,
731821-82-2,
1-Indolizinecarbonitrile,2-(chloromethyl)-,
1-Indolizinecarbonitrile, 2-(chloromethyl)-,
AC1M73CO,
AC1Q3U2L,
SCHEMBL18580948,
CTK5D7523,
DTXSID00368556,
ZINC3294783,
MFCD04628566,
AKOS008967138,
MCULE-5816844293,
NE21695,
RT-007196,
FT-0691267,
EN300-25795,
ZINC03294783,
CID2410363,
|
| Complexity | 232 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 190.03g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 190.63g/mol |
| Monoisotopic Mass | 190.03g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 28.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.6 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number