| CAS Number | 1956330-87-2 |
| Catalog Number | AG00I3FV(AGN-PC-0WAMIS) |
| Chemical Name | 2-(Aminomethyl)-6-methylphenol hydrochloride |
| IUPAC Name | 2-(aminomethyl)-6-methylphenol;hydrochloride |
| InChI | InChI=1S/C8H11NO.ClH/c1-6-3-2-4-7(5-9)8(6)10;/h2-4,10H,5,9H2,1H3;1H |
| InChI Key | XXNYCPDBFKBDHL-UHFFFAOYSA-N |
| MDL Number | MFCD29761111 |
| Molecular Formula | C8H12ClNO |
| Molecular Weight | 173.6400 |
| SMILES | OC1=C(C)C=CC=C1CN.[H]Cl |
| Synonyms | 2-(Aminomethyl)-6-methylphenol hydrochloride,
1956330-87-2,
KS-00000LDB,
2-(Aminomethyl)-6-methylphenol HCl,
MFCD29761111,
AKOS027337374,
AK338973,
DS-12595,
AX8300222,
2-(aminomethyl)-6-methylphenol;hydrochloride,
|
| Complexity | 105 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 173.061g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 173.64g/mol |
| Monoisotopic Mass | 173.061g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 46.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
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Hazard Class
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Hazard statements
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H302-H315-H319-H335
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Packing Group
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Precautionary statements
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P261-P305+P351+P338
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UN Code
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Certificate of Analysis
Lot Number