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143833-10-7 | 1H-Indole-1-acetic acid, 5-chloro-
CAS No: 143833-10-7 Catalog No: AG001IG5 MDL No:MFCD18900019
Product Description
Catalog Number:
AG001IG5
Chemical Name:
1H-Indole-1-acetic acid, 5-chloro-
CAS Number:
143833-10-7
Molecular Formula:
C10H8ClNO2
Molecular Weight:
209.6290
MDL Number:
MFCD18900019
IUPAC Name:
2-(5-chloroindol-1-yl)acetic acid
InChI:
InChI=1S/C10H8ClNO2/c11-8-1-2-9-7(5-8)3-4-12(9)6-10(13)14/h1-5H,6H2,(H,13,14)
InChI Key:
GIJZRQHQWCJJQO-UHFFFAOYSA-N
SMILES:
OC(=O)Cn1ccc2c1ccc(c2)Cl
Properties
Complexity:
234
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.024g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
209.629g/mol
Monoisotopic Mass:
209.024g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
42.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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