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1566454-66-7

1566454-66-7 | 4-[METHYL(PROP-2-YN-1-YL)AMINO]THIOPHENE-2-CARBALDEHYDE

CAS No: 1566454-66-7 Catalog No: AG01C8OC MDL No:MFCD26866545

Product Description

Catalog Number:
AG01C8OC
Chemical Name:
4-[METHYL(PROP-2-YN-1-YL)AMINO]THIOPHENE-2-CARBALDEHYDE
CAS Number:
1566454-66-7
Molecular Formula:
C9H9NOS
Molecular Weight:
179.2389
MDL Number:
MFCD26866545
IUPAC Name:
4-[methyl(prop-2-ynyl)amino]thiophene-2-carbaldehyde
InChI:
InChI=1S/C9H9NOS/c1-3-4-10(2)8-5-9(6-11)12-7-8/h1,5-7H,4H2,2H3
InChI Key:
ZXRVRCFHECCXKE-UHFFFAOYSA-N
SMILES:
C#CCN(c1csc(c1)C=O)C

Properties

Complexity:
208  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.04g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
179.237g/mol
Monoisotopic Mass:
179.04g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
48.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  

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