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142057-17-8 | Phenol, 4-(2-aminoethyl)-2-methyl-
CAS No: 142057-17-8 Catalog No: AG001HNX MDL No:
Product Description
Catalog Number:
AG001HNX
Chemical Name:
Phenol, 4-(2-aminoethyl)-2-methyl-
CAS Number:
142057-17-8
Molecular Formula:
C9H13NO
Molecular Weight:
151.2056
IUPAC Name:
4-(2-aminoethyl)-2-methylphenol
InChI:
InChI=1S/C9H13NO/c1-7-6-8(4-5-10)2-3-9(7)11/h2-3,6,11H,4-5,10H2,1H3
InChI Key:
XUUUAVMDYPPDOI-UHFFFAOYSA-N
SMILES:
NCCc1ccc(c(c1)C)O
Properties
Complexity:
116
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
151.1g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
151.209g/mol
Monoisotopic Mass:
151.1g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
46.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
Literature
| Title | Journal |
|---|---|
| Modulation of dopaminergic neurotransmission in rat striatum upon in vitro and in vivo diclofenac treatment. | Journal of neurochemistry 20080401 |
| Expression of human organic anion transporters in the choroid plexus and their interactions with neurotransmitter metabolites. | Journal of pharmacological sciences 20031201 |
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