(3aS,3a'S,7aS,7a'S)-2,2'-(((2S,4S)-Pentane-2,4-diyl)bis(oxy))bis(1,3-diphenyloctahydro-1H-benzo[d][1,3,2]diazaphosphole)

Catalog Number	ACM1384619231
CAS	1384619-23-1
Structure
Synonyms	(3aS,7aS)-2-[(2S,4S)-4-[[(3aS,7aS)-1,3-diphenyl-3a,4,5,6,7,7a-hexahydrobenzo[d][1,3,2]diazaphosphol-2-yl]oxy]pentan-2-yl]oxy-1,3-diphenyl-3a,4,5,6,7,7a-hexahydrobenzo[d][1,3,2]diazaphosphole
IUPAC Name	(3aS,7aS)-2-[(2S,4S)-4-[[(3aS,7aS)-1,3-diphenyl-3a,4,5,6,7,7a-hexahydrobenzo[d][1,3,2]diazaphosphol-2-yl]oxy]pentan-2-yl]oxy-1,3-diphenyl-3a,4,5,6,7,7a-hexahydrobenzo[d][1,3,2]diazaphosphole
Molecular Weight	692.81
Molecular Formula	C41H50N4O2P2
InChI	WRCZYHWWUWWAJL-FKSBZZDOSA-N
InChI Key	InChI=1S/C41H50N4O2P2/c1-32(46-48-42(34-19-7-3-8-20-34)38-27-15-16-28-39(38)43(48)35-21-9-4-10-22-35)31-33(2)47-49-44(36-23-11-5-12-24-36)40-29-17-18-30-41(40)45(49)37-25-13-6-14-26-37/h3-14,19-26,32-33,38-41H,15-18,27-31H2,1-2H3/t32-,33-,38-,39-,40-,41-/m0/s1
Purity	98%
Isomeric SMILES	C[C@@H](C[C@H](C)OP1N([C@H]2CCCC[C@@H]2N1C3=CC=CC=C3)C4=CC=CC=C4)OP5N([C@H]6CCCC[C@@H]6N5C7=CC=CC=C7)C8=CC=CC=C8

Q&A

What is the IUPAC name of (3aS,3a'S,7aS,7a'S)-2,2'-(((2S,4S)-Pentane-2,4-diyl)bis(oxy))bis(1,3-diphenyloctahydro-1H-benzo[d][1,3,2]diazaphosphole)?

(3aS,7aS)-2-[(2S,4S)-4-[[(3aS,7aS)-1,3-diphenyl-3a,4,5,6,7,7a-hexahydrobenzo[d][1,3,2]diazaphosphol-2-yl]oxy]pentan-2-yl]oxy-1,3-diphenyl-3a,4,5,6,7,7a-hexahydrobenzo[d][1,3,2]diazaphosphole

What is the molecular formula of (3aS,3a'S,7aS,7a'S)-2,2'-(((2S,4S)-Pentane-2,4-diyl)bis(oxy))bis(1,3-diphenyloctahydro-1H-benzo[d][1,3,2]diazaphosphole)?

C41H50N4O2P2

What is the molecular weight of (3aS,3a'S,7aS,7a'S)-2,2'-(((2S,4S)-Pentane-2,4-diyl)bis(oxy))bis(1,3-diphenyloctahydro-1H-benzo[d][1,3,2]diazaphosphole)?

692.8g/mol

How many covalently-bonded units are in (3aS,3a'S,7aS,7a'S)-2,2'-(((2S,4S)-Pentane-2,4-diyl)bis(oxy))bis(1,3-diphenyloctahydro-1H-benzo[d][1,3,2]diazaphosphole)?

1

What is the mono isotopic mass of (3aS,3a'S,7aS,7a'S)-2,2'-(((2S,4S)-Pentane-2,4-diyl)bis(oxy))bis(1,3-diphenyloctahydro-1H-benzo[d][1,3,2]diazaphosphole)?

692.34090085

How many hydrogen bond acceptors are in (3aS,3a'S,7aS,7a'S)-2,2'-(((2S,4S)-Pentane-2,4-diyl)bis(oxy))bis(1,3-diphenyloctahydro-1H-benzo[d][1,3,2]diazaphosphole)?

6

What is the Canonical SMILES representation of (3aS,3a'S,7aS,7a'S)-2,2'-(((2S,4S)-Pentane-2,4-diyl)bis(oxy))bis(1,3-diphenyloctahydro-1H-benzo[d][1,3,2]diazaphosphole)?

CC(CC(C)OP1N(C2CCCCC2N1C3=CC=CC=C3)C4=CC=CC=C4)OP5N(C6CCCCC6N5C7=CC=CC=C7)C8=CC=CC=C8

What is the XLogP3 value of (3aS,3a'S,7aS,7a'S)-2,2'-(((2S,4S)-Pentane-2,4-diyl)bis(oxy))bis(1,3-diphenyloctahydro-1H-benzo[d][1,3,2]diazaphosphole)?

11.2

What is the InChiKey of (3aS,3a'S,7aS,7a'S)-2,2'-(((2S,4S)-Pentane-2,4-diyl)bis(oxy))bis(1,3-diphenyloctahydro-1H-benzo[d][1,3,2]diazaphosphole)?

WRCZYHWWUWWAJL-FKSBZZDOSA-N

What is the depositor-supplied synonym for (3aS,3a'S,7aS,7a'S)-2,2'-(((2S,4S)-Pentane-2,4-diyl)bis(oxy))bis(1,3-diphenyloctahydro-1H-benzo[d][1,3,2]diazaphosphole)?

(3aS,3a'S,7aS,7a'S)-2,2'-(((2S,4S)-pentane-2,4-diyl)bis(oxy))bis(1,3-diphenyloctahydro-1H-benzo[d][1,3,2]diazaphosphole)