Name: Name:2-Chloro-1,3-bis(2,6-diisopropylphenyl)-1h-imidazol-3-ium chloride
Brand: Angene
SKU: AG000JJA
Rating: 90 (10 reviews)

2-Chloro-1,3-bis(2,6-diisopropylphenyl)-1h-imidazol-3-ium chloride

CAS No.:

1228185-09-8

Catalog Number:

AG000JJA

Molecular Formula:

C27H38Cl2N2

Molecular Weight:

461.5100

Catalog Number:

AG000JJA

Chemical Name:

2-Chloro-1,3-bis(2,6-diisopropylphenyl)-1h-imidazol-3-ium chloride

CAS Number:

1228185-09-8

Molecular Formula:

C27H38Cl2N2

Molecular Weight:

461.5100

MDL Number:

MFCD23703069

IUPAC Name:

2-chloro-1,3-bis[2,6-di(propan-2-yl)phenyl]imidazol-1-ium;chloride

InChI:

InChI=1S/C27H36ClN2.ClH/c1-17(2)21-11-9-12-22(18(3)4)25(21)29-15-16-30(27(29)28)26-23(19(5)6)13-10-14-24(26)20(7)8;/h9-20H,1-8H3;1H/q+1;/p-1

InChI Key:

JDMACANGISWEGX-UHFFFAOYSA-M

SMILES:

CC(c1cccc(c1N1C=C[NH+](C1Cl)c1c(cccc1C(C)C)C(C)C)C(C)C)C.[Cl-]

Complexity:

453

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

458.226g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

459.499g/mol

Monoisotopic Mass:

458.226g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

8.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count: