2-[3-[Bis(1-methylethyl)Amino]-1-Phenylpropyl]-4-methyl Phenol monohydrobromide

• CAS: 124936-74-9
• Catalog Number: ACM124936749
• Category: Bromine Series
• Molecular Weight: 406.41
• Molecular Formula: C₂₂H₃₁NO?HBr
• Synonyms: 2-[3-[BIS(1-METHYLETHYL)AMINO]-1-PHENYLPROPYL]-4-METHYLPHENOL MONOHYDROBROMIDE;(R)-2,3-BIS(1-METHYLETHYL)AMINO-1-PHENYLPROPYL-4-METHYLPHENOL;TOLTERODINE HYDROBROMIC ACID SALT;2-[3-BIS(1-METHYLETHYL)AMINO]-1-PHENYLPROPYL]-4-METHYLPHENOL HBR;2-[3-[BIS(1-ME
• IUPAC Name: 2-[3-[di(propan-2-yl)amino]-1-phenylpropyl]-4-methylphenol
• Canonical SMILES: CC1=CC(=C(C=C1)O)C(CCN(C(C)C)C(C)C)C2=CC=CC=C2
• InChI Key: OOGJQPCLVADCPB-UHFFFAOYSA-N
• Boiling Point: 473ºC at 760 mmHg
• Flash Point: 239.9ºC
• Exact Mass: 325.24100
• H-Bond Acceptor: 2
• H-Bond Donor: 1

Custom Q&A

What is the molecular formula of tolterodine?

The molecular formula of tolterodine is C22H31NO.

What is the molecular weight of tolterodine?

The molecular weight of tolterodine is 325.5 g/mol.

What is the IUPAC name of tolterodine?

The IUPAC name of tolterodine is 2-[(1R)-3-[di(propan-2-yl)amino]-1-phenylpropyl]-4-methylphenol.

What is the InChI of tolterodine?

The InChI of tolterodine is InChI=1S/C22H31NO/c1-16(2)23(17(3)4)14-13-20(19-9-7-6-8-10-19)21-15-18(5)11-12-22(21)24/h6-12,15-17,20,24H,13-14H2,1-5H3/t20-/m1/s1.

What is the InChIKey of tolterodine?

The InChIKey of tolterodine is OOGJQPCLVADCPB-HXUWFJFHSA-N.

What is the canonical SMILES of tolterodine?

The canonical SMILES of tolterodine is CC1=CC(=C(C=C1)O)C(CCN(C(C)C)C(C)C)C2=CC=CC=C2.

What is the CAS number of tolterodine?

The CAS number of tolterodine is 124937-51-5.

What is the ChEMBL ID of tolterodine?

The ChEMBL ID of tolterodine is CHEMBL1382.

What is the XLogP3-AA value of tolterodine?

The XLogP3-AA value of tolterodine is 5.6.

How many rotatable bonds does tolterodine have?

Tolterodine has 7 rotatable bonds.