Name: Name:5,10,15,20-Tetrakis(2,6-dichlorophenyl)porphine
Brand: Angene
SKU: AG003M8C
Rating: 90 (10 reviews)

5,10,15,20-Tetrakis(2,6-dichlorophenyl)porphine

CAS No.:

37083-37-7

Catalog Number:

AG003M8C

Molecular Formula:

C44H22Cl8N4

Molecular Weight:

890.2963

Catalog Number:

AG003M8C

Chemical Name:

5,10,15,20-Tetrakis(2,6-dichlorophenyl)porphine

CAS Number:

37083-37-7

Molecular Formula:

C44H22Cl8N4

Molecular Weight:

890.2963

MDL Number:

MFCD00191500

IUPAC Name:

5,10,15,20-tetrakis(2,6-dichlorophenyl)-21,23-dihydroporphyrin

InChI:

InChI=1S/C44H22Cl8N4/c45-21-5-1-6-22(46)37(21)41-29-13-15-31(53-29)42(38-23(47)7-2-8-24(38)48)33-17-19-35(55-33)44(40-27(51)11-4-12-28(40)52)36-20-18-34(56-36)43(32-16-14-30(41)54-32)39-25(49)9-3-10-26(39)50/h1-20,53,56H

InChI Key:

UQASJTNIEXIESH-UHFFFAOYSA-N

SMILES:

Clc1cccc(c1C1=C2C=CC(=N2)C(=c2ccc(=C(C3=NC(=C(c4[nH]c1cc4)c1c(Cl)cccc1Cl)C=C3)c1c(Cl)cccc1Cl)[nH]2)c1c(Cl)cccc1Cl)Cl

Complexity:

1090

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

889.929g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

890.288g/mol

Monoisotopic Mass:

885.935g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

57.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

15.4