Tranylcypromine hydrochloride - CAS 1986-47-6
Catalog:
BB015357
Product Name:
Tranylcypromine hydrochloride
CAS:
1986-47-6
Synonyms:
(1R,2S)-2-phenylcyclopropan-1-amine;hydrochloride
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BB015357
1 g
$298
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Related CAS: 155-09-9
IUPAC Name: (1R,2S)-2-phenylcyclopropan-1-amine;hydrochloride
Description: Tranylcypromine is a monoamine oxidase inhibitor, which inhibits CYP2A6 with Ki of 0.08 μM and 0.2 μM in cDNA-expressing microsomes and human liver microsomes, respectively.
Molecular Weight: 169.65
Molecular Formula: C9H12ClN
Canonical SMILES: C1C(C1N)C2=CC=CC=C2.Cl
InChI: InChI=1S/C9H11N.ClH/c10-9-6-8(9)7-4-2-1-3-5-7;/h1-5,8-9H,6,10H2;1H/t8-,9+;/m0./s1
InChI Key: ZPEFMSTTZXJOTM-OULXEKPRSA-N
Boiling Point: 218.3 °C at 760 mmHg
Purity: > 98 %
Solubility: >25.4 [ug/mL] (The mean of the results at pH 7.4)
Appearance: Yellow powder
MDL: MFCD00063602
LogP: 3.00350
GHS Hazard Statement: H302 (97.56%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement: P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word: Warning
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Complexity: 116
Compound Is Canonicalized: Yes
Covalently-Bonded Unit Count: 2
Defined Atom Stereocenter Count: 2
Defined Bond Stereocenter Count: 0
Exact Mass: 169.0658271
Formal Charge: 0
Heavy Atom Count: 11
Hydrogen Bond Acceptor Count: 1
Hydrogen Bond Donor Count: 2
Isotope Atom Count: 0
Monoisotopic Mass: 169.0658271
Rotatable Bond Count: 1
Topological Polar Surface Area: 26 Å2
Undefined Atom Stereocenter Count: 0
Undefined Bond Stereocenter Count: 0
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