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1003-90-3 | 1H-Pyrrole, 2,3,4,5-tetramethyl-
CAS No: 1003-90-3 Catalog No: AG0001JD MDL No:
Product Description
Catalog Number:
AG0001JD
Chemical Name:
1H-Pyrrole, 2,3,4,5-tetramethyl-
CAS Number:
1003-90-3
Molecular Formula:
C8H13N
Molecular Weight:
123.1955
IUPAC Name:
2,3,4,5-tetramethyl-1H-pyrrole
InChI:
InChI=1S/C8H13N/c1-5-6(2)8(4)9-7(5)3/h9H,1-4H3
InChI Key:
BDXJANJAHYKTMI-UHFFFAOYSA-N
SMILES:
Cc1[nH]c(c(c1C)C)C
EC Number:
213-717-0
Properties
Complexity:
88.7
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
123.105g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
123.199g/mol
Monoisotopic Mass:
123.105g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
15.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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