Chemical Properties of Phendimetrazine (CAS 634-03-7)

InChI

InChI=1S/C12H17NO/c1-10-12(14-9-8-13(10)2)11-6-4-3-5-7-11/h3-7,10,12H,8-9H2,1-2H3

InChI Key

MFOCDFTXLCYLKU-UHFFFAOYSA-N

Formula

C12H17NO

SMILES

CC1C(c2ccccc2)OCCN1C

Molecular Weight¹

191.27

CAS

634-03-7

Other Names

• Bontril
• (+)-Phendimetrazine
• Morpholine, 3,4-dimethyl-2-phenyl-, (2S-trans)-
• Morpholine, 3,4-dimethyl-2-phenyl-, (+)-
• (+)-3,4-Dimethyl-2-phenylmorpholine
• D-2-phenyl-3,4-dimethylmorpholine
• Antapentan
• Mephenmetrazine
• Sedafamen
• Adphen (base)
• Bacarate
• (2S,3S)-3,4-Dimethyl-2-phenylmorpholine
• NSC 169187
• (2S-trans)-3,4-Dimethyl-2-phenylmorpholine
• Phendimetracine

• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• I_np : Non-polar retention indices.
• I : Polar retention indices.
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
log10WS	-2.07		Crippen Calculated Property
logPoct/wat	2.078		Crippen Calculated Property
McVol	161.170	ml/mol	McGowan Calculated Property
Inp	[1431.00; 1507.00]
Inp	1450.00		NIST
Inp	1450.00		NIST
Inp	1485.00		NIST
Inp	1485.00		NIST
Inp	1431.00		NIST
Inp	1445.00		NIST
Inp	1466.00		NIST
Inp	1475.00		NIST
Inp	1482.00		NIST
Inp	1500.00		NIST
Inp	1505.00		NIST
Inp	1507.00		NIST
Inp	1434.00		NIST
Inp	1445.00		NIST
Inp	1444.00		NIST
Inp	1450.00		NIST
Inp	1444.00		NIST
I	[1963.00; 2057.00]
I	1963.00		NIST
I	1963.00		NIST
I	2002.00		NIST
I	2009.00		NIST
I	2017.00		NIST
I	2047.00		NIST
I	2057.00		NIST

Similar Compounds

Find more compounds similar to Phendimetrazine.

Sources

• Crippen Method
• Crippen Method
• McGowan Method
• NIST Webbook

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