CS-M2680
3-((Nitrooxy)methyl)phenyl isonicotinate
Manufacturer: ChemScene
CAS Number: 2444010-45-9
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Purity
98%
MDL No
None
Storage
4°C
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₁₃H₁₀N₂O₅
Molecular Weight
274.23
Synonyms
None
SMILES
[O-][N+](OCC1=CC(OC(C2=CC=NC=C2)=O)=CC=C1)=O
Tpsa
91.56
Logp
2.0091
H Acceptors
6
H Donors
0
Rotatable Bonds
5
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SAFETY INFORMATION
Pictograms
Signal Word
Warning
UN Number
N/A
Class
N/A
Packing Group
N/A
Hazard Statements
Precautionary Statements
P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
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Purity: 98%
MDL No: None
Storage: 4°C
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₁₀N₂O₅
Molecular Weight: 274.23
Synonyms: None
SMILES: [O-][N+](OCC1=CC(OC(C2=CC=NC=C2)=O)=CC=C1)=O
Tpsa: 91.56
Logp: 2.0091
H Acceptors: 6
H Donors: 0
Rotatable Bonds: 5
Purity:
98%
MDL No:
None
Storage:
4°C
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₁₀N₂O₅
Molecular Weight:
274.23
Synonyms:
None
SMILES:
[O-][N+](OCC1=CC(OC(C2=CC=NC=C2)=O)=CC=C1)=O
Tpsa:
91.56
Logp:
2.0091
H Acceptors:
6
H Donors:
0
Rotatable Bonds:
5
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₁₃NO₂
Molecular Weight: 143.18
Synonyms: Morpholine, 4-(oxiranylmethyl)-,(S)-
SMILES: [C@@H]1(CN2CCOCC2)OC1
Tpsa: 25
Logp: -0.2826
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇H₁₃NO₂
Molecular Weight:
143.18
Synonyms:
Morpholine, 4-(oxiranylmethyl)-,(S)-
SMILES:
[C@@H]1(CN2CCOCC2)OC1
Tpsa:
25
Logp:
-0.2826
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
2
Purity: 98%
MDL No: MFCD00059934
Storage: 4°C
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C12H16O4
Molecular Weight: 224.25
Synonyms: Benzo-12-crown 4-ether
SMILES: C12=CC=CC=C1OCCOCCOCCO2
Tpsa: 36.92
Logp: 1.491
H Acceptors: 4
H Donors: 0
Rotatable Bonds: 0
Purity:
98%
MDL No:
MFCD00059934
Storage:
4°C
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C12H16O4
Molecular Weight:
224.25
Synonyms:
Benzo-12-crown 4-ether
SMILES:
C12=CC=CC=C1OCCOCCOCCO2
Tpsa:
36.92
Logp:
1.491
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
0
Purity: 98%
MDL No: None
Storage: 4°C
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₁₅NO₆
Molecular Weight: 269.25
Synonyms: 13-nitro-1,4,7,10-benzotetraoxa-15-cyclododecene
SMILES: [O-][N+](C1=CC(OCCOCCOCCO2)=C2C=C1)=O
Tpsa: 80.06
Logp: 1.3992
H Acceptors: 6
H Donors: 0
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
4°C
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₁₅NO₆
Molecular Weight:
269.25
Synonyms:
13-nitro-1,4,7,10-benzotetraoxa-15-cyclododecene
SMILES:
[O-][N+](C1=CC(OCCOCCOCCO2)=C2C=C1)=O
Tpsa:
80.06
Logp:
1.3992
H Acceptors:
6
H Donors:
0
Rotatable Bonds:
1