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3-(2-Hydroxy-1-methyl-2-nitrosohydrazino)-N-methyl-1-propanamine

HCID 135410175
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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
146724-84-7
Standard SMILES
CNCCCN(C)/[N+]([O-])=N\O
InChIKey
BPBUJYBQUBMWDT-VQHVLOKHSA-N
Molecular formula
C5H14N4O2
Average molar mass
162.19 g/mol
Monoisotopic mass
162.1116757

Names & identifiers

Preferred name
3-(2-Hydroxy-1-methyl-2-nitrosohydrazino)-N-methyl-1-propanamine
IUPAC
(E)-hydroxyimino-[methyl-[3-(methylamino)propyl]amino]-oxidoazanium
English name
NOC-7
Molecular formula
C5H14N4O2
Molecular weight
162.19

Names & synonyms

noc-71-Propanamine, 3-(2-hydroxy-1-methyl-2-nitrosohydrazino)-N-methyl-3-(2-Hydroxy-1-methyl-2-nitrosohydrazino)-N-methyl-1-propanamine146724-84-7NOC 7E5T57V6AVU1-Propanamine, 3-(2-hydroxy-1-methyl-2-nitrosohydrazinyl)-N-methyl-(1Z)-1-(hydroxyimino)-2-methyl-2-[3-(methylamino)propyl]hydrazin-1-ium-1-olate3-(2-Hydroxy-1-methyl-2-nitrosohydrazinyl)-N-methyl-1-propanamine3-(2-HydroxyNOC-7 - CAS 146724-84-7 - Calbiochem1-hydroxy-3-methyl-3-(methyl-*aminopropyl)-2-oxo-
Show more names
1-HYDROXY-2-OXO-3-(N-METHYLAMINOPROPYL)3-METHYL-1-TRIAZENE1-Hydroxy-2-oxo-3-(N-methyl-3-aminoethyl)-3-methyl-1-triazene3-(2-Hydroxy-1-methyl-2-nitrosohydrazino)-N-methylpropylamine1-HYDROXY-2-OXO-3-(N-3-METHYL-AMINOPROPYL)-3-METHYL-1-TRIAZENE

Database identifiers

Properties

Computed structural properties

XLogP
0.4
Topological polar surface area
76.6 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
5
Rotatable bonds
5
Heavy atoms
11
Formal charge
0
Complexity
128

Physicochemical properties

Boiling point
250.4 · 250.4±42.0 °C(Predicted)
Density
1.18 · 1.18±0.1 g/cm3(Predicted)
storage temp.
-20 C · -20C
solubility
Water
form
White solid
pka
0.18 · 0.18±0.69(Predicted)
color
White
Water Solubility
0.1 M · 0.1 M NaOH: solublewater: soluble
Stability
-20 °C, · Store at -20°C, Light and Moisture Sensitive
InChI
1S/C5H14N4O2/c1-6-4-3-5-8(2)9(11)7-10/h6,11H,3-5H2,1-2H3
InChIKey
AXAGAUVQMYPYHM-UHFFFAOYSA-N
UNSPSC Code
12352200 · 12352200
WGK Germany
3 · WGK 3
Storage Class
11 · 11 - Combustible Solids

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

wgk
WGK 3
Storage Class
11 - Combustible Solids

Chemistry & industry

Applications

UsesA stable NO-amine complex which can release NO spontaneously under physiological conditions. The half life of NO release in 0.1 M PBS at (pH7.4) at 37C for 0.1mM NOC 5 is 5 minutes.

Suppliers5 total

陕西缔都新材料有限公司81124267 17392282731 · [email protected]
武汉易泰科技有限公司上海分公司18930552037 · [email protected]
安耐吉化学&3A(安徽泽升科技股份有限公司)400-0056266 · [email protected]
上海一飞生物科技有限公司021-65675885 18964387627 · [email protected]
Shanxi Xuanran Import and Export Trade Co., Ltd.+8617735180244 · [email protected]

Related reactions

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Compound notes

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On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
CAS
146724-84-7
PubChem CID
135410175
UNII
E5T57V6AVU