1-(4-Chlorophenyl)cyclobutanemethanamine - CAS 63010-09-3
Catalog: |
BB031939 |
Product Name: |
1-(4-Chlorophenyl)cyclobutanemethanamine |
CAS: |
63010-09-3 |
Synonyms: |
[1-(4-chlorophenyl)cyclobutyl]methanamine; [1-(4-chlorophenyl)cyclobutyl]methanamine |
IUPAC Name: | [1-(4-chlorophenyl)cyclobutyl]methanamine |
Description: | 1-(4-Chlorophenyl)cyclobutanemethanamine (CAS# 63010-09-3) is a useful research chemical. |
Molecular Weight: | 195.69 |
Molecular Formula: | C11H14ClN |
Canonical SMILES: | C1CC(C1)(CN)C2=CC=C(C=C2)Cl |
InChI: | InChI=1S/C11H14ClN/c12-10-4-2-9(3-5-10)11(8-13)6-1-7-11/h2-5H,1,6-8,13H2 |
InChI Key: | VJISRXVFSSVMQD-UHFFFAOYSA-N |
Boiling Point: | 285.4 °C at 760 mmHg |
Density: | 1.149 g/cm3 |
MDL: | MFCD06213128 |
LogP: | 3.42070 |
GHS Hazard Statement: | H319 (97.44%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] |
Precautionary Statement: | P264, P280, P305+P351+P338, and P337+P313 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
US-10174039-B2 | P2X3 and/or P2X2/3 compounds and methods | 20160930 |
US-10611768-B2 | P2X3 and/or P2X2/3 compounds and methods | 20160930 |
US-2018093991-A1 | P2x3 and/or p2x2/3 compounds and methods | 20160930 |
US-2019092778-A1 | P2x3 and/or p2x2/3 compounds and methods | 20160930 |
US-2020190096-A1 | P2x3 and/or p2x2/3 compounds and methods | 20160930 |
Complexity: | 169 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 195.0814771 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 195.0814771 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 26 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.7 |
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