(S)-(+)-(3,5-Dioxa-4-phospha-cyclohepta[2,1-a;3,4-a']dinaphthalen-4-yl)piperidine

Catalog Number	ACM284472793-1
CAS	284472-79-3
Structure
Synonyms	1-(11bS)-Dinaphtho[2,1-d:1',2'-f][1,3,2]dioxaphosphepin-4-yl-piperidine; (S)-PipPhos
IUPAC Name	1-(12,14-dioxa-13-phosphapentacyclo[13.8.0.02,11.03,8.018,23]tricosa-1(15),2(11),3,5,7,9,16,18,20,22-decaen-13-yl)piperidine
Molecular Weight	399.40
Molecular Formula	C25H22NO2P
InChI	ZYDGLCZCEANEHK-UHFFFAOYSA-N
InChI Key	InChI=1S/C25H22NO2P/c1-6-16-26(17-7-1)29-27-22-14-12-18-8-2-4-10-20(18)24(22)25-21-11-5-3-9-19(21)13-15-23(25)28-29/h2-5,8-15H,1,6-7,16-17H2
Boiling Point	597.5±33.0 °C(Predicted)
Melting Point	206-213 °C
Appearance	Solid
Isomeric SMILES	C1CCN(CC1)P2OC3=C(C4=CC=CC=C4C=C3)C5=C(O2)C=CC6=CC=CC=C65
pKa	1.67±0.20(Predicted)

Q&A

What is the molecular formula of (S)-(+)-(3,5-Dioxa-4-phospha-cyclohepta[2,1-a;3,4-a']dinaphthalen-4-yl)piperidine?

The molecular formula of (S)-(+)-(3,5-Dioxa-4-phospha-cyclohepta[2,1-a;3,4-a']dinaphthalen-4-yl)piperidine is C29H38NO2P.

What is the molecular weight of (S)-(+)-(3,5-Dioxa-4-phospha-cyclohepta[2,1-a;3,4-a']dinaphthalen-4-yl)piperidine?

The molecular weight of (S)-(+)-(3,5-Dioxa-4-phospha-cyclohepta[2,1-a;3,4-a']dinaphthalen-4-yl)piperidine is 463.6 g/mol.

How many heavy atoms are present in (S)-(+)-(3,5-Dioxa-4-phospha-cyclohepta[2,1-a;3,4-a']dinaphthalen-4-yl)piperidine?

There are 33 heavy atoms present in (S)-(+)-(3,5-Dioxa-4-phospha-cyclohepta[2,1-a;3,4-a']dinaphthalen-4-yl)piperidine.

How many hydrogen bond acceptors are present in (S)-(+)-(3,5-Dioxa-4-phospha-cyclohepta[2,1-a;3,4-a']dinaphthalen-4-yl)piperidine?

There are 3 hydrogen bond acceptors present in (S)-(+)-(3,5-Dioxa-4-phospha-cyclohepta[2,1-a;3,4-a']dinaphthalen-4-yl)piperidine.

What is the exact mass of (S)-(+)-(3,5-Dioxa-4-phospha-cyclohepta[2,1-a;3,4-a']dinaphthalen-4-yl)piperidine?

The exact mass of (S)-(+)-(3,5-Dioxa-4-phospha-cyclohepta[2,1-a;3,4-a']dinaphthalen-4-yl)piperidine is 463.26401645.

What is the IUPAC name of (S)-(+)-(3,5-Dioxa-4-phospha-cyclohepta[2,1-a;3,4-a']dinaphthalen-4-yl)piperidine?

The IUPAC name of (S)-(+)-(3,5-Dioxa-4-phospha-cyclohepta[2,1-a;3,4-a']dinaphthalen-4-yl)piperidine is 1-[(11R)-12,14-dioxa-13-phosphapentacyclo[13.8.0.0²,¹¹.0³,⁸.0¹⁸,²³]tricosa-1(¹⁵),2,4,6,8,16,18,22-octaen-13-yl]piperidine; ethane.

What is the canonical SMILES representation of (S)-(+)-(3,5-Dioxa-4-phospha-cyclohepta[2,1-a;3,4-a']dinaphthalen-4-yl)piperidine?

The canonical SMILES representation of (S)-(+)-(3,5-Dioxa-4-phospha-cyclohepta[2,1-a;3,4-a']dinaphthalen-4-yl)piperidine is CC.CC.C1CCN(CC1)P2OC3CC=C4C=CC=CC4=C3C5=C(O2)C=CC6=CCCC=C65.

How many covalently-bonded units are present in (S)-(+)-(3,5-Dioxa-4-phospha-cyclohepta[2,1-a;3,4-a']dinaphthalen-4-yl)piperidine?

There are 3 covalently-bonded units present in (S)-(+)-(3,5-Dioxa-4-phospha-cyclohepta[2,1-a;3,4-a']dinaphthalen-4-yl)piperidine.

What is the topological polar surface area of (S)-(+)-(3,5-Dioxa-4-phospha-cyclohepta[2,1-a;3,4-a']dinaphthalen-4-yl)piperidine?

The topological polar surface area of (S)-(+)-(3,5-Dioxa-4-phospha-cyclohepta[2,1-a;3,4-a']dinaphthalen-4-yl)piperidine is 21.7.

What is the InChIKey of (S)-(+)-(3,5-Dioxa-4-phospha-cyclohepta[2,1-a;3,4-a']dinaphthalen-4-yl)piperidine?

The InChIKey of (S)-(+)-(3,5-Dioxa-4-phospha-cyclohepta[2,1-a;3,4-a']dinaphthalen-4-yl)piperidine is NQQFCPYGKXWKJN-FPRUJGGXSA-N.