| CAS Number | 69957-96-6 |
| Catalog Number | AG00FFBS(AGN-PC-0WAMU1) |
| Chemical Name | (2-Chloro-4-methylphenyl)methanamine |
| IUPAC Name | (2-chloro-4-methylphenyl)methanamine |
| InChI | InChI=1S/C8H10ClN/c1-6-2-3-7(5-10)8(9)4-6/h2-4H,5,10H2,1H3 |
| InChI Key | WPPROWZRWXCTSA-UHFFFAOYSA-N |
| MDL Number | MFCD06213616 |
| Molecular Formula | C8H10ClN |
| Molecular Weight | 155.6247 |
| SMILES | CC1=CC(Cl)=C(CN)C=C1 |
| Synonyms | (2-Chloro-4-methylphenyl)methanamine,
69957-96-6,
2-Chloro-4-methylbenzylamine,
SCHEMBL5768687,
CTK8C4386,
DTXSID30717437,
KS-00000PI7,
0833AC,
ANW-71722,
MFCD06213616,
ZINC44250011,
AKOS006350875,
CS-W006931,
1-(2-Chloro-4-methylphenyl)methanamine,
AK-76787,
DS-16752,
AJ-109628,
ST2402197,
TC-160467,
4CH-017103,
C8H10ClN,
|
| Complexity | 105 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 155.05g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 155.625g/mol |
| Monoisotopic Mass | 155.05g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 26A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.8 |
GHS Hazard and Precautionary Statements
| Symbol: |   |
|
Hazard Class
|
8
|
|
Hazard statements
|
H302-H315-H318-H335
|
|
Packing Group
|
Ⅱ
|
|
Precautionary statements
|
P261-P280-P305+P351+P338
|
|
UN Code
|
UN 2735
|
Certificate of Analysis
Lot Number