N-Nitroso-N-isopropylglycine

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Basic information

CAS: 6939-16-8
Standard SMILES: CC(C)N(CC(=O)O)N=O
InChIKey: GKJHQLTUEGQHOI-UHFFFAOYSA-N
Molecular formula: C5H10N2O3
Average molar mass: 146.14 g/mol
Monoisotopic mass: 146.06914219

Names & identifiers

Preferred name: N-Nitroso-N-isopropylglycine
IUPAC: 2-[nitroso(propan-2-yl)amino]acetic acid

Names & synonyms

6939-16-8Glycine, N-(1-methylethyl)-N-nitroso-N-nitroso-N-isopropylglycineFV8ZO38TAJUNII-FV8ZO38TAJNSC 56785NSC-56785DTXSID70219501GLYCINE, N-ISOPROPYL-N-NITROSO-2-((1-METHYLETHYL)NITROSOAMINO)ACETIC ACIDACETIC ACID, 2-((1-METHYLETHYL)NITROSOAMINO)-RefChem:202199

Show more names

DTXCID501419922-[nitroso(propan-2-yl)amino]acetic acidN-Isopropyl-N-nitrosoglycine[nitroso(propan-2-yl)amino]acetic acidNSC567852-[nitroso(propan-2-yl)amino]aceticacidIsoproterenol Nitroso Impurity 56N- Nitroso Isoprenaline Impurity 37

Database identifiers

CAS: 6939-16-8
PubChem CID: 96156
DTXSID: DTXSID70219501
UNII: FV8ZO38TAJ

Properties

Computed structural properties

XLogP: 0.6
Topological polar surface area: 70 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 5
Rotatable bonds: 3
Heavy atoms: 10
Formal charge: 0
Complexity: 135

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Compound notes

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