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77740-83-1 | 3-amino-4-chloro-benzaldehyde
CAS No: 77740-83-1 Catalog No: AG0057SW MDL No:MFCD17168736
Product Description
Catalog Number:
AG0057SW
Chemical Name:
3-amino-4-chloro-benzaldehyde
CAS Number:
77740-83-1
Molecular Formula:
C7H6ClNO
Molecular Weight:
155.5816
MDL Number:
MFCD17168736
IUPAC Name:
3-amino-4-chlorobenzaldehyde
InChI:
InChI=1S/C7H6ClNO/c8-6-2-1-5(4-10)3-7(6)9/h1-4H,9H2
InChI Key:
KLIDNCHOWGDFKQ-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(c(c1)N)Cl
NSC Number:
57185
Properties
Complexity:
129
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
155.014g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
155.581g/mol
Monoisotopic Mass:
155.014g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
43.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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