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13796-06-0 | 2-Nitro-5-chlorobenzaldehyde dimethyl acetal
CAS No: 13796-06-0 Catalog No: AG00AJME MDL No:
Product Description
Catalog Number:
AG00AJME
Chemical Name:
2-Nitro-5-chlorobenzaldehyde dimethyl acetal
CAS Number:
13796-06-0
IUPAC Name:
4-chloro-2-(dimethoxymethyl)-1-nitrobenzene
InChI:
InChI=1S/C9H10ClNO4/c1-14-9(15-2)7-5-6(10)3-4-8(7)11(12)13/h3-5,9H,1-2H3
InChI Key:
IAUJGFVKHWXBFX-UHFFFAOYSA-N
Properties
Complexity:
217
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.03g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
231.632g/mol
Monoisotopic Mass:
231.03g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
64.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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