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1620-19-5 | Benzenaminium, 3-hydroxy-N,N,N-trimethyl-, bromide (1:1)
CAS No: 1620-19-5 Catalog No: AG001SMA MDL No:
Product Description
Catalog Number:
AG001SMA
Chemical Name:
Benzenaminium, 3-hydroxy-N,N,N-trimethyl-, bromide (1:1)
CAS Number:
1620-19-5
Molecular Formula:
C9H14BrNO
Molecular Weight:
232.1176
IUPAC Name:
(3-hydroxyphenyl)-trimethylazanium;bromide
InChI:
InChI=1S/C9H13NO.BrH/c1-10(2,3)8-5-4-6-9(11)7-8;/h4-7H,1-3H3;1H
InChI Key:
MKRZGVCMTCPWHY-UHFFFAOYSA-N
SMILES:
Oc1cccc(c1)[N+](C)(C)C.[Br-]
UNII:
8BBF2W6V08
Properties
Complexity:
128
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.026g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
232.121g/mol
Monoisotopic Mass:
231.026g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Literature
| Title | Journal |
|---|---|
| Structural transformation of apocytochrome c induced by alternating copolymers of maleic acid and alkene. | Biomacromolecules 20050101 |
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