4-(1-Pyrrolidinyl)benzyl Alcohol - CAS 676245-12-8
Catalog: |
BB033344 |
Product Name: |
4-(1-Pyrrolidinyl)benzyl Alcohol |
CAS: |
676245-12-8 |
Synonyms: |
[4-(1-pyrrolidinyl)phenyl]methanol; (4-pyrrolidin-1-ylphenyl)methanol |
IUPAC Name: | (4-pyrrolidin-1-ylphenyl)methanol |
Description: | 4-(1-Pyrrolidinyl)benzyl Alcohol (CAS# 676245-12-8) is a useful research chemical. |
Molecular Weight: | 177.24 |
Molecular Formula: | C11H15NO |
Canonical SMILES: | C1CCN(C1)C2=CC=C(C=C2)CO |
InChI: | InChI=1S/C11H15NO/c13-9-10-3-5-11(6-4-10)12-7-1-2-8-12/h3-6,13H,1-2,7-9H2 |
InChI Key: | URPRBAHGHXSPKI-UHFFFAOYSA-N |
Boiling Point: | 343 °C at 760 mmHg |
Density: | 1.123 g/cm3 |
MDL: | MFCD06203114 |
LogP: | 1.84410 |
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 |
US-2017145013-A1 | Dihydropteridinone derivatives and uses thereof | 20140808 |
US-9951074-B2 | Dihydropteridinone derivatives and uses thereof | 20140808 |
WO-2011143651-A1 | Compositions and methods for modulating metabolism | 20100514 |
Complexity: | 146 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 177.115364102 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 177.115364102 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 23.5 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.7 |
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