200,000+ products from a single source!
sales@angenechem.com
Home > Aldehydes > 1216113-27-7
1216113-27-7 | 1H-Indole-4-carboxaldehyde, 3-chloro-
CAS No: 1216113-27-7 Catalog No: AG0015EA MDL No:MFCD12402552
Product Description
Catalog Number:
AG0015EA
Chemical Name:
1H-Indole-4-carboxaldehyde, 3-chloro-
CAS Number:
1216113-27-7
Molecular Formula:
C9H6ClNO
Molecular Weight:
179.6030
MDL Number:
MFCD12402552
IUPAC Name:
3-chloro-1H-indole-4-carbaldehyde
InChI:
InChI=1S/C9H6ClNO/c10-7-4-11-8-3-1-2-6(5-12)9(7)8/h1-5,11H
InChI Key:
YNUGQROAODSSTJ-UHFFFAOYSA-N
SMILES:
O=Cc1cccc2c1c(Cl)c[nH]2
Properties
Complexity:
185
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.014g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
179.603g/mol
Monoisotopic Mass:
179.014g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
32.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.