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2-(1-(Amino-dideuteriomethyl)cyclohexyl)-2,2-dideuterioacetic acid

CAS: 1185039-20-6
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1185039-20-6

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1 DTXSID20661990
2 2-(1-(Amino-dideuteriomethyl)cyclohexyl)-2,2-dideuterioacetic acid
3 2-[1-(Amino-dideuteriomethyl)cyclohexyl]-2,2-dideuterioacetic acid
4 RefChem:1060630
5 DTXCID10612739

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Molecular Formula C9H17NO2
Canonical SMILES
Isomeric SMILES
Molecular Weight 175.2600
InChIKey UGJMXCAKCUNAIE-KXGHAPEVSA-N
InChI InChI=1S/C9H17NO2/c10-7-9(6-8(11)12)4-2-1-3-5-9/h1-7,10H2,(H,11,12)/i6D2,7D2
XLogP -1.1000
ExactMass 175.1510
MonoisotopicMass 175.1510
TPSA 63.3000
Complexity 162.0000
Charge 0.0000
HBondDonorCount 2
HBondAcceptorCount 3
RotatableBondCount 3
HeavyAtomCount 12
IsotopeAtomCount 4
AtomStereoCount 0
DefinedAtomStereoCount 0
UndefinedAtomStereoCount 0
BondStereoCount 0
DefinedBondStereoCount 0
UndefinedBondStereoCount 0
CovalentUnitCount 1
PatentCount 5
PatentFamilyCount 2
LiteratureCount 0