CS-1077713
9-Nitro-1,2,3,4,4a,5-hexahydro-7H-benzo[E]pyrazino[2,1-c][1,4]oxazepine
Manufacturer: ChemScene
CAS Number: 2795150-92-2
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Purity
98%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₁₂H₁₅N₃O₃
Molecular Weight
249.27
Synonyms
None
SMILES
O=N(=O)C1=CC=C2C(=C1)COCC3N2CCNC3
Tpsa
67.64
Logp
0.9032
H Acceptors
5
H Donors
1
Rotatable Bonds
1
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: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₁₅N₃O₃
Molecular Weight: 249.27
Synonyms: None
SMILES: O=N(=O)C1=CC=C2C(=C1)COCC3N2CCNC3
Tpsa: 67.64
Logp: 0.9032
H Acceptors: 5
H Donors: 1
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₁₅N₃O₃
Molecular Weight:
249.27
Synonyms:
None
SMILES:
O=N(=O)C1=CC=C2C(=C1)COCC3N2CCNC3
Tpsa:
67.64
Logp:
0.9032
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
1
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₂₁NO₅
Molecular Weight: 259.30
Synonyms: None
SMILES: C(OC(C)(C)C)(=O)N1C(C(OC)=O)C[C@@H](OC)C1
Tpsa: 65.07
Logp: 1.1838
H Acceptors: 5
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:
C₁₂H₂₁NO₅
Molecular Weight:
259.30
Synonyms:
None
SMILES:
C(OC(C)(C)C)(=O)N1C(C(OC)=O)C[C@@H](OC)C1
Tpsa:
65.07
Logp:
1.1838
H Acceptors:
5
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: C₇H₆ClN₃
Molecular Weight: 167.60
Synonyms: None
SMILES: ClC=1N=C(C2=CC=NN2C1)C
Tpsa: 30.19
Logp: 1.69112
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇H₆ClN₃
Molecular Weight:
167.60
Synonyms:
None
SMILES:
ClC=1N=C(C2=CC=NN2C1)C
Tpsa:
30.19
Logp:
1.69112
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
0
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₁₆FN₃O₃
Molecular Weight: 281.28
Synonyms: None
SMILES: O=C(OC(C)(C)C)N(C=1C=C(F)C2=C(O)C=NN2C1)C
Tpsa: 67.07
Logp: 2.5503
H Acceptors: 5
H Donors: 1
Rotatable Bonds: 1
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₁₆FN₃O₃
Molecular Weight:
281.28
Synonyms:
None
SMILES:
O=C(OC(C)(C)C)N(C=1C=C(F)C2=C(O)C=NN2C1)C
Tpsa:
67.07
Logp:
2.5503
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
1