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Home > Other Building Blocks > 138119-05-8
138119-05-8 | Phenol, 3-[(1,4-dimethyl-9H-carbazol-9-yl)methyl]-
CAS No: 138119-05-8 Catalog No: AG00180D MDL No:
Product Description
Catalog Number:
AG00180D
Chemical Name:
Phenol, 3-[(1,4-dimethyl-9H-carbazol-9-yl)methyl]-
CAS Number:
138119-05-8
Molecular Formula:
C21H19NO
Molecular Weight:
301.3817
IUPAC Name:
3-[(1,4-dimethylcarbazol-9-yl)methyl]phenol
InChI:
InChI=1S/C21H19NO/c1-14-10-11-15(2)21-20(14)18-8-3-4-9-19(18)22(21)13-16-6-5-7-17(23)12-16/h3-12,23H,13H2,1-2H3
InChI Key:
VCEZBOFOEPIHQG-UHFFFAOYSA-N
SMILES:
Oc1cccc(c1)Cn1c2ccccc2c2c1c(C)ccc2C
Properties
Complexity:
411
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
301.147g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
301.389g/mol
Monoisotopic Mass:
301.147g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
25.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.3
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