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Home > Aldehydes > 299936-03-1
299936-03-1 | 1-[2-(2-METHOXY-PHENOXY)-ETHYL]-1H-INDOLE-3-CARBALDEHYDE
CAS No: 299936-03-1 Catalog No: AG00BDM3 MDL No:MFCD02049624
Product Description
Catalog Number:
AG00BDM3
Chemical Name:
1-[2-(2-METHOXY-PHENOXY)-ETHYL]-1H-INDOLE-3-CARBALDEHYDE
CAS Number:
299936-03-1
Molecular Formula:
C18H17NO3
Molecular Weight:
295.3325
MDL Number:
MFCD02049624
IUPAC Name:
1-[2-(2-methoxyphenoxy)ethyl]indole-3-carbaldehyde
InChI:
InChI=1S/C18H17NO3/c1-21-17-8-4-5-9-18(17)22-11-10-19-12-14(13-20)15-6-2-3-7-16(15)19/h2-9,12-13H,10-11H2,1H3
InChI Key:
PUNPSTCJCHVHQR-UHFFFAOYSA-N
SMILES:
COc1ccccc1OCCn1cc(c2c1cccc2)C=O
Properties
Complexity:
362
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
295.121g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
295.338g/mol
Monoisotopic Mass:
295.121g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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