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72237-78-6 | 3H-Carbazole-2-carboxaldehyde,4,9-dihydro-6-methoxy-1,4-dimethyl-
CAS No: 72237-78-6 Catalog No: AG005V0S MDL No:
Product Description
Catalog Number:
AG005V0S
Chemical Name:
3H-Carbazole-2-carboxaldehyde,4,9-dihydro-6-methoxy-1,4-dimethyl-
CAS Number:
72237-78-6
Molecular Formula:
C16H17NO2
Molecular Weight:
255.3117
IUPAC Name:
6-methoxy-1,4-dimethyl-4,9-dihydro-3H-carbazole-2-carbaldehyde
InChI:
InChI=1S/C16H17NO2/c1-9-6-11(8-18)10(2)16-15(9)13-7-12(19-3)4-5-14(13)17-16/h4-5,7-9,17H,6H2,1-3H3
InChI Key:
NMQSCTOGZSRWRM-UHFFFAOYSA-N
SMILES:
O=CC1=C(C)c2c(C(C1)C)c1c([nH]2)ccc(c1)OC
EC Number:
276-505-7
Properties
Complexity:
404
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
255.126g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
255.317g/mol
Monoisotopic Mass:
255.126g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
42.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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