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N,N-Dipropyldinaphtho[2,1-d:1',2'-f][1,3,2]dioxaphosphepin-4-amine

Catalog Number
ACM802902369
Product Name
N,N-Dipropyldinaphtho[2,1-d:1',2'-f][1,3,2]dioxaphosphepin-4-amine
Structure
N,N-Dipropyldinaphtho[2,1-d:1',2'-f][1,3,2]dioxaphosphepin-4-amine
CAS
802902-36-9
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Synonyms
3,4-a']dinaphthalen-4-yl)dipropylaMine; N,N-Dipropyldinaphtho[2,1-d:1',2'-f][1,3,2]dioxaphosphepin-4-amine; CS-0062237; KS-00000Q7Z; MFCD27920535;
IUPAC Name
N,N-dipropyl-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-amine;
Molecular Weight
415.473g/mol
Molecular Formula
C26H26NO2P;
Canonical SMILES
CCCN(CCC)P1OC2=C(C3=CC=CC=C3C=C2)C4=C(O1)C=CC5=CC=CC=C54;
InChI
InChI=1S/C26H26NO2P/c1-3-17-27(18-4-2)30-28-23-15-13-19-9-5-7-11-21(19)25(23)26-22-12-8-6-10-20(22)14-16-24(26)29-30/h5-16H,3-4,17-18H2,1-2H3;
InChI Key
MLHMEHOYQRTGQZ-UHFFFAOYSA-N;
Complexity
513
Covalently-Bonded Unit Count
1
Exact Mass
415.17g/mol
H-Bond Acceptor
3
Heavy Atom Count
30
Monoisotopic Mass
415.17g/mol
Rotatable Bond Count
5
Topological Polar Surface Area
29.5A^2
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