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Home > Aldehydes > 2060021-61-4
2060021-61-4 | 2-chloro-1-(2-chloroethyl)-1H-imidazole-5-carbaldehyde
CAS No: 2060021-61-4 Catalog No: AG01BX3F MDL No:MFCD30477675
Product Description
Catalog Number:
AG01BX3F
Chemical Name:
2-chloro-1-(2-chloroethyl)-1H-imidazole-5-carbaldehyde
CAS Number:
2060021-61-4
Molecular Formula:
C6H6Cl2N2O
Molecular Weight:
193.0306
MDL Number:
MFCD30477675
IUPAC Name:
2-chloro-3-(2-chloroethyl)imidazole-4-carbaldehyde
InChI:
InChI=1S/C6H6Cl2N2O/c7-1-2-10-5(4-11)3-9-6(10)8/h3-4H,1-2H2
InChI Key:
SETZALYZECFVOH-UHFFFAOYSA-N
SMILES:
ClCCn1c(Cl)ncc1C=O
Properties
Complexity:
145
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.986g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
193.027g/mol
Monoisotopic Mass:
191.986g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
34.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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