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2059971-25-2 | 7-nitro-1,2,3,4-tetrahydronaphthalene-2-carbaldehyde
CAS No: 2059971-25-2 Catalog No: AG01BP0A MDL No:MFCD30499753
Product Description
Catalog Number:
AG01BP0A
Chemical Name:
7-nitro-1,2,3,4-tetrahydronaphthalene-2-carbaldehyde
CAS Number:
2059971-25-2
Molecular Formula:
C11H11NO3
Molecular Weight:
205.2099
MDL Number:
MFCD30499753
IUPAC Name:
7-nitro-1,2,3,4-tetrahydronaphthalene-2-carbaldehyde
InChI:
InChI=1S/C11H11NO3/c13-7-8-1-2-9-3-4-11(12(14)15)6-10(9)5-8/h3-4,6-8H,1-2,5H2
InChI Key:
HTWRVXBCFHDCMK-UHFFFAOYSA-N
SMILES:
O=CC1CCc2c(C1)cc(cc2)[N+](=O)[O-]
Properties
Complexity:
261
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.074g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
205.213g/mol
Monoisotopic Mass:
205.074g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
62.9A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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