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Home > Aldehydes > 102735-84-2
102735-84-2 | 1H-Indazole-3-carboxaldehyde, 5-chloro-
CAS No: 102735-84-2 Catalog No: AG000892 MDL No:MFCD07781535
Product Description
Catalog Number:
AG000892
Chemical Name:
1H-Indazole-3-carboxaldehyde, 5-chloro-
CAS Number:
102735-84-2
Molecular Formula:
C8H5ClN2O
Molecular Weight:
180.5911
MDL Number:
MFCD07781535
IUPAC Name:
5-chloro-2H-indazole-3-carbaldehyde
InChI:
InChI=1S/C8H5ClN2O/c9-5-1-2-7-6(3-5)8(4-12)11-10-7/h1-4H,(H,10,11)
InChI Key:
XQELXOTYHCBYAI-UHFFFAOYSA-N
SMILES:
Clc1cc2c(C=O)n[nH]c2cc1
Properties
Complexity:
188
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.009g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
180.591g/mol
Monoisotopic Mass:
180.009g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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