| CAS Number | 84672-90-2 |
| Catalog Number | AG004SZ5(AGN-PC-00KDR7) |
| Chemical Name | 2-[(Propylamino)methyl]phenol |
| IUPAC Name | 2-(propylaminomethyl)phenol |
| InChI | InChI=1S/C10H15NO/c1-2-7-11-8-9-5-3-4-6-10(9)12/h3-6,11-12H,2,7-8H2,1H3 |
| InChI Key | NUHMTAQXBQRVOI-UHFFFAOYSA-N |
| MDL Number | MFCD09951050 |
| Molecular Formula | C10H15NO |
| Molecular Weight | 165.2322 |
| SMILES | CCCNCC1=C(O)C=CC=C1 |
| Synonyms | 2-[(propylamino)methyl]phenol,
84672-90-2,
2-((propylamino)methyl)phenol,
Phenol, 2-[(propylamino)methyl]-,
N-propyl-N-o-hydroxybenzylamine,
2-(Propylaminomethyl)phenol,
AC1Q2Y58,
SCHEMBL1238295,
CTK3D0028,
KS-00001LBS,
DTXSID00514571,
NUHMTAQXBQRVOI-UHFFFAOYSA-N,
MFCD09951050,
ZINC19519526,
AKOS000196606,
MCULE-3099779488,
NE19903,
EN300-62849,
Z1076533308,
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| Complexity | 116 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 165.115g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 165.236g/mol |
| Monoisotopic Mass | 165.115g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 32.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.9 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number