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1152975-49-9 | 2-chloro-6-(1H-pyrazol-1-yl)benzaldehyde
CAS No: 1152975-49-9 Catalog No: AG01A4C7 MDL No:MFCD11156412
Product Description
Catalog Number:
AG01A4C7
Chemical Name:
2-chloro-6-(1H-pyrazol-1-yl)benzaldehyde
CAS Number:
1152975-49-9
Molecular Formula:
C10H7ClN2O
Molecular Weight:
206.6284
MDL Number:
MFCD11156412
IUPAC Name:
2-chloro-6-pyrazol-1-ylbenzaldehyde
InChI:
InChI=1S/C10H7ClN2O/c11-9-3-1-4-10(8(9)7-14)13-6-2-5-12-13/h1-7H
InChI Key:
BULVWSWDCIRHEL-UHFFFAOYSA-N
SMILES:
O=Cc1c(Cl)cccc1n1cccn1
Properties
Complexity:
212
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.025g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
206.629g/mol
Monoisotopic Mass:
206.025g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
34.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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