| CAS Number | 1044256-78-1 |
| Catalog Number | AG01DKPJ |
| Chemical Name | (2-Chloro-3-methylphenyl)methanamine |
| IUPAC Name | (2-chloro-3-methylphenyl)methanamine |
| InChI | InChI=1S/C8H10ClN/c1-6-3-2-4-7(5-10)8(6)9/h2-4H,5,10H2,1H3 |
| InChI Key | IFLOMUXTUMCCFZ-UHFFFAOYSA-N |
| MDL Number | MFCD11045179 |
| Molecular Formula | C8H10ClN |
| Molecular Weight | 155.6247 |
| SMILES | NCC1=CC=CC(C)=C1Cl |
| Synonyms | 2-Chloro-3-methylbenzylamine,
1044256-78-1,
(2-chloro-3-methylphenyl)methanamine,
2-chloro-3-methyl-benzylamine,
SCHEMBL1151364,
IFLOMUXTUMCCFZ-UHFFFAOYSA-N,
MFCD11045179,
ZINC79387686,
AKOS006308904,
AS-46470,
FT-0728186,
2-chloro-3-methylBenzenemethanamine,
|
| 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: |  |
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Hazard Class
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\N
|
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Hazard statements
|
H302
|
|
Packing Group
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\N
|
|
Precautionary statements
|
P280-P305+P351+P338
|
|
UN Code
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\N
|
Certificate of Analysis
Lot Number