Home Halogens Ethanone, 2-chloro-1-(1-cyclopropyl-2,5-dimethyl-1H-pyrrol-3-yl)- (9CI)

Ethanone, 2-chloro-1-(1-cyclopropyl-2,5-dimethyl-1H-pyrrol-3-yl)- (9CI)

CAS No.:
744227-04-1
Catalog Number:
AG00FO08
Molecular Formula:
C11H14ClNO
Molecular Weight:
211.6880
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Product Description
Catalog Number:
AG00FO08
Chemical Name:
Ethanone, 2-chloro-1-(1-cyclopropyl-2,5-dimethyl-1H-pyrrol-3-yl)- (9CI)
CAS Number:
744227-04-1
Molecular Formula:
C11H14ClNO
Molecular Weight:
211.6880
MDL Number:
MFCD05266688
IUPAC Name:
2-chloro-1-(1-cyclopropyl-2,5-dimethylpyrrol-3-yl)ethanone
InChI:
InChI=1S/C11H14ClNO/c1-7-5-10(11(14)6-12)8(2)13(7)9-3-4-9/h5,9H,3-4,6H2,1-2H3
InChI Key:
VDOWBQXUDGEQHE-UHFFFAOYSA-N
SMILES:
ClCC(=O)c1cc(n(c1C)C1CC1)C
Properties
Complexity:
239  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.076g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
211.689g/mol
Monoisotopic Mass:
211.076g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
22A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties