(R)-2-(Benzylamino)-1-phenylethanol - CAS 107171-75-5
Catalog: |
BB001986 |
Product Name: |
(R)-2-(Benzylamino)-1-phenylethanol |
CAS: |
107171-75-5 |
Synonyms: |
(1R)-1-phenyl-2-[(phenylmethyl)amino]ethanol; (1R)-2-(benzylamino)-1-phenylethanol |
IUPAC Name: | (1R)-2-(benzylamino)-1-phenylethanol |
Description: | (R)-2-(Benzylamino)-1-phenylethanol (CAS# 107171-75-5 ) is a useful research chemical. |
Molecular Weight: | 227.30 |
Molecular Formula: | C15H17NO |
Canonical SMILES: | C1=CC=C(C=C1)CNCC(C2=CC=CC=C2)O |
InChI: | InChI=1S/C15H17NO/c17-15(14-9-5-2-6-10-14)12-16-11-13-7-3-1-4-8-13/h1-10,15-17H,11-12H2/t15-/m0/s1 |
InChI Key: | XAOCLQUZOIZSHV-HNNXBMFYSA-N |
Boiling Point: | 375.2 °C at 760 mmHg |
Density: | 1.1 g/cm3 |
Storage: | Keep in dark place, Inert atmosphere, Room temperature |
MDL: | MFCD03427122 |
LogP: | 2.90070 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CA-2220759-C | 1,4-benzodioxin derivatives | 19950512 |
EP-0825189-A1 | 1,4-benzodioxin derivatives | 19950512 |
EP-0825189-B1 | 1,4-benzodioxin derivatives | 19950512 |
JP-3068198-B2 | 1,4-benzodioxin derivative | 19950512 |
KR-100490003-B1 | 1,4-benzodioxin derivatives | 19950512 |
Complexity: | 195 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 1 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 227.131014166 |
Formal Charge: | 0 |
Heavy Atom Count: | 17 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 227.131014166 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 32.3 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.1 |
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