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189892-86-2 | 1H-Pyrrole, 2,4-dimethyl-1-octadecyl-
CAS No: 189892-86-2 Catalog No: AG002E3T MDL No:
Product Description
Catalog Number:
AG002E3T
Chemical Name:
1H-Pyrrole, 2,4-dimethyl-1-octadecyl-
CAS Number:
189892-86-2
Molecular Formula:
C24H45N
Molecular Weight:
347.6208
IUPAC Name:
2,4-dimethyl-1-octadecylpyrrole
InChI:
InChI=1S/C24H45N/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-25-22-23(2)21-24(25)3/h21-22H,4-20H2,1-3H3
InChI Key:
IXYXREOUOSOATB-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCCCCCCCn1cc(cc1C)C
Properties
Complexity:
275
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
347.355g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
347.631g/mol
Monoisotopic Mass:
347.355g/mol
Rotatable Bond Count:
17
Topological Polar Surface Area:
4.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
10.2
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