Results for:
chemical Classification: morpholines

4-nitrosomorpholine

Compound Details

Synonymous names
N-NITROSOMORPHOLINE
59-89-2
4-Nitrosomorpholine
Nitrosomorpholine
Morpholine, 4-nitroso-
NMOR
N-Nitrosomorpholin
Morpholine, N-nitroso-
N-Nitrosomorfolin
NCI-C02164
4-Nitroso-morpholine
3L25FO7FN7
DTXSID4021056
CHEBI:76326
NSC-139
DTXCID001056
NSC 139
N-Nitrosomorfolin [Czech]
CAS-59-89-2
N-Nitrosomorpholin [German]
67587-56-8
CCRIS 473
Molsidomine impurity B
HSDB 4308
BRN 0112139
UNII-3L25FO7FN7
N-nitroso morpholine
N-Nitrosomorpholine solution
WLN: T6N DOTJ ANO
N-Nitrosomorpholine (NMOR)
CHEMBL165908
NSC139
SCHEMBL1578515
N-NITROSOMORPHOLINE [MI]
N-NITROSOMORPHOLINE [HSDB]
N-NITROSOMORPHOLINE [IARC]
Tox21_202132
Tox21_302867
MFCD00039710
STL301087
AKOS015903272
NCGC00249174-01
NCGC00256343-01
NCGC00259681-01
BS-17191
SY052130
4-Nitrosomorpholine 0.1 mg/ml in Methanol
4-Nitrosomorpholine 1.0 mg/ml in Methanol
DB-053489
HY-131123
CS-0128913
N0466
NS00010254
C19283
N-Nitrosomorpholine 100 microg/mL in Methanol
T72681
EN300-7323775
Q22138414
Z1255360497
Molsidomine impurity B, European Pharmacopoeia (EP) Reference Standard
Microorganism:

Yes

IUPAC name4-nitrosomorpholine
SMILESC1COCCN1N=O
InchiInChI=1S/C4H8N2O2/c7-5-6-1-3-8-4-2-6/h1-4H2
FormulaC4H8N2O2
PubChem ID6046
Molweight116.12
LogP-0.4
Atoms8
Bonds0
H-bond Acceptor4
H-bond Donor0
Chemical Classificationnitroso compounds nitrogen compounds morpholines heterocyclic compounds ethers
CHEBI-ID76326
Supernatural-IDSN0473195

mVOC Specific Details

Boiling Point
DegreeReference
224 °C peer reviewed
Volatilization
The Henry's Law constant for N-nitrosomorpholine is 2.45X10-8 atm-cu-m/mol at 37 °C(1). This value indicates that N-nitrosomorpholine will be essentially nonvolatile from water surfaces(2). Although N-nitrosomorpholine's estimated vapor pressure of 0.036 mm Hg at 20 °C(3) and measured Henry's Law constant suggest that volatilization from dry and moist soil is not expected to occur(SRC), inhalation toxicity studies found that N-nitrosomorpholine was volatile at room temperatures with inhalation exposure possible(4).
Soil Adsorption
Using a structure estimation method based on molecular connectivity indices(1), the Koc of N-nitrosomorpholine can be estimated to be 22(SRC). The Koc of N-nitrosomorpholine can be estimated as 4(SRC), using a log Kow of -0.44(2) and a regression-derived equation(1). According to a classification scheme(3), these estimated Koc values suggest that N-nitrosodiethylamine is expected to have very high mobility in soil.
Vapor Pressure
PressureReference
25
Massbank-Links

Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
Lactobacillus PlantarumZhang et al. 2023
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
Lactobacillus PlantarumHabanero pepperGC–IMSno


N-(4-iodophenyl)-4-(morpholin-4-ylmethyl)benzamide

Compound Details

Synonymous names
HIF-1 inhibitor-4
333357-56-5
N-(4-Iodophenyl)-4-(morpholinomethyl)benzamide
CHEMBL3335134
N-(4-iodophenyl)-4-(morpholin-4-ylmethyl)benzamide
WAY-299838
CBMicro_029098
Cambridge id 5712502
Oprea1_018329
Oprea1_299669
N-(4-Iodo-phenyl)-4-morpholin-4-ylmethyl-benzamide
ZOFBYPLMJZJZIK-UHFFFAOYSA-N
BDBM50058784
STL112941
AKOS000597097
WAY-299838?
DA-74158
TS-09370
BIM-0028952.P001
HY-153017
CS-0646846
G72053
AB00094398-01
N-(4-Iodophenyl)-4-(4-morpholinylmethyl)benzamide #
Z57263926
Microorganism:

No

IUPAC nameN-(4-iodophenyl)-4-(morpholin-4-ylmethyl)benzamide
SMILESC1COCCN1CC2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)I
InchiInChI=1S/C18H19IN2O2/c19-16-5-7-17(8-6-16)20-18(22)15-3-1-14(2-4-15)13-21-9-11-23-12-10-21/h1-8H,9-13H2,(H,20,22)
FormulaC18H19IN2O2
PubChem ID589919
Molweight422.3
LogP1.9
Atoms23
Bonds4
H-bond Acceptor3
H-bond Donor1
Chemical Classificationamides aromatic compounds benzenoids halogenated compounds heterocyclic compounds morpholines nitrogen compounds

mVOC Specific Details


Species emitting the compound
KingdomSpeciesBiological FunctionOrigin/HabitatReference
Aspergillus NigerKate et al. 2023
Method
KingdomSpeciesGrowth MediumApplied MethodVerification
Aspergillus Nigerinoculated potato samplesGC-MSno