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30310-80-6

30310-80-6 Structure

30310-80-6 Structure
IdentificationBack Directory
[Name]

N-Nitroso-L-hydroxyproline
[CAS]

30310-80-6
[Synonyms]

NITROSOHYDROXYPROLINE
N-NITROSOHYDROXYPROLINE
N-Nitroso-L-hydroxyproline
1-Nitroso-4β-hydroxy-L-proline
(4R)-1-Nitroso-4-hydroxy-L-proline
(4R)-4-Hydroxy-1-nitroso-L-proline
L-Proline, 4-hydroxy-1-nitroso-, (4R)-
L-Proline, 4-hydroxy-1-nitroso-, (4R)- (9CI)
1-Nitroso-4β-hydroxypyrrolidine-2α-carboxylic acid
[Molecular Formula]

C5H8N2O4
[MOL File]

30310-80-6.mol
[Molecular Weight]

160.13
Chemical PropertiesBack Directory
[Melting point ]

129-131°C
[Boiling point ]

286°C (rough estimate)
[density ]

1.5101 (rough estimate)
[refractive index ]

1.4472 (estimate)
[storage temp. ]

-20°C Freezer
[solubility ]

Acetone (Slightly), DMSO (Slightly), Water (Slightly)
[form ]

Solid
[pka]

3.02±0.40(Predicted)
[color ]

Pale Brown to Light Brown
[InChI]

InChI=1S/C5H8N2O4/c8-3-1-4(5(9)10)7(2-3)6-11/h3-4,8H,1-2H2,(H,9,10)/t3-,4+/m1/s1
[InChIKey]

ABVBOWJCKJGCJM-DMTCNVIQSA-N
[SMILES]

C(O)(=O)[C@@H]1C[C@@H](O)CN1N=O
[IARC]

3 (Vol. 17, Sup 7) 1987
Hazard InformationBack Directory
[Chemical Properties]

Tan Solid
[Uses]

A carcinogenic nitrosamine; N-nitrosoamino acid derivative found in cured meat products.
[Definition]

ChEBI: N-Nitrosohydroxyproline is a L-proline derivative.
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