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87896-32-0 | Methanaminium, 1-carboxy-N,N,N-trimethyl-, fluoride
CAS No: 87896-32-0 Catalog No: AG004E3N MDL No:
Product Description
Catalog Number:
AG004E3N
Chemical Name:
Methanaminium, 1-carboxy-N,N,N-trimethyl-, fluoride
CAS Number:
87896-32-0
Molecular Formula:
C5H12FNO2
Molecular Weight:
137.1527
IUPAC Name:
carboxymethyl(trimethyl)azanium;fluoride
InChI:
InChI=1S/C5H11NO2.FH/c1-6(2,3)4-5(7)8;/h4H2,1-3H3;1H
InChI Key:
XSWBNXNGEAOXRJ-UHFFFAOYSA-N
SMILES:
OC(=O)C[N+](C)(C)C.[F-]
Properties
Complexity:
93.1
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
137.085g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
137.154g/mol
Monoisotopic Mass:
137.085g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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