Home Carbonyls 1H-Indole-1-carbonyl chloride, 2,3-dihydro- (9CI)

1H-Indole-1-carbonyl chloride, 2,3-dihydro- (9CI)

CAS No.:
117086-91-6
Catalog Number:
AG009PRA
Molecular Formula:
C9H8ClNO
Molecular Weight:
181.6189
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Product Description
Catalog Number:
AG009PRA
Chemical Name:
1H-Indole-1-carbonyl chloride, 2,3-dihydro- (9CI)
CAS Number:
117086-91-6
Molecular Formula:
C9H8ClNO
Molecular Weight:
181.6189
IUPAC Name:
2,3-dihydroindole-1-carbonyl chloride
InChI:
InChI=1S/C9H8ClNO/c10-9(12)11-6-5-7-3-1-2-4-8(7)11/h1-4H,5-6H2
InChI Key:
BHVDNQHSQZMQMJ-UHFFFAOYSA-N
SMILES:
ClC(=O)N1CCc2c1cccc2
Properties
Complexity:
195  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.029g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
181.619g/mol
Monoisotopic Mass:
181.029g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties