3-Amino-3-(o-tolyl)-1-propanol - CAS 21464-52-8
Catalog: |
BB016886 |
Product Name: |
3-Amino-3-(o-tolyl)-1-propanol |
CAS: |
21464-52-8 |
Synonyms: |
3-amino-3-(2-methylphenyl)-1-propanol; 3-amino-3-(2-methylphenyl)propan-1-ol |
IUPAC Name: | 3-amino-3-(2-methylphenyl)propan-1-ol |
Description: | γ-Amino-2-methylbenzenepropanol, can be used in the synthesis of potential antitumor agents, such as 4-arylcyclophosphamides. |
Molecular Weight: | 165.23 |
Molecular Formula: | C10H15NO |
Canonical SMILES: | CC1=CC=CC=C1C(CCO)N |
InChI: | InChI=1S/C10H15NO/c1-8-4-2-3-5-9(8)10(11)6-7-12/h2-5,10,12H,6-7,11H2,1H3 |
InChI Key: | SSTJWHUMHSFYDT-UHFFFAOYSA-N |
Boiling Point: | 155 °C (8 mmHg) |
LogP: | 2.07750 |
Publication Number | Title | Priority Date |
CA-2755641-A1 | Substituted 2-acetamido-5-aryl-1,2,4-triazolones and use thereof | 20090318 |
CA-2755641-C | Substituted 2-acetamido-5-aryl-1,2,4-triazolones and use thereof | 20090318 |
DE-102010001064-A1 | Substituted 2-acetamido-5-aryl-1,2,4-triazolones and their use | 20090318 |
EA-023694-B1 | SUBSTITUTED 2-ACETAMIDO-5-ARIL-1,2,4-TRIAZOLONES AND THEIR APPLICATION | 20090318 |
EP-2408751-A1 | Substituted 2-acetamido-5-aryl-1,2,4-triazolones and use thereof | 20090318 |
Complexity: | 127 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 165.115364102 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 165.115364102 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 46.2 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.9 |
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