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147057-79-2 | 1H-Pyrrole-3-carbonyl chloride, 1,2,5-trimethyl-
CAS No: 147057-79-2 Catalog No: AG001EJU MDL No:MFCD04972634
Product Description
Catalog Number:
AG001EJU
Chemical Name:
1H-Pyrrole-3-carbonyl chloride, 1,2,5-trimethyl-
CAS Number:
147057-79-2
Molecular Formula:
C8H10ClNO
Molecular Weight:
171.6241
MDL Number:
MFCD04972634
IUPAC Name:
1,2,5-trimethylpyrrole-3-carbonyl chloride
InChI:
InChI=1S/C8H10ClNO/c1-5-4-7(8(9)11)6(2)10(5)3/h4H,1-3H3
InChI Key:
SRZUCWIAAOZAOQ-UHFFFAOYSA-N
SMILES:
ClC(=O)c1cc(n(c1C)C)C
Properties
Complexity:
172
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
171.045g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
171.624g/mol
Monoisotopic Mass:
171.045g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
22A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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