CS-0803830
[rel-(1S,2S,6R)-2-(tert-butoxycarbonylamino)-6-methyl-4-(3-nitro-4-pyridyl)cyclohex-3-en-1-yl] acetate
Manufacturer: ChemScene
CAS Number: 1187056-19-4
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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
C₁₉H₂₅N₃O₆
Molecular Weight
391.42
Synonyms
None
SMILES
CC(=O)O[C@@H]1[C@@H](NC(=O)OC(C)(C)C)C=C(C[C@H]1C)C2C(=CN=CC=2)[N+](=O)[O-]
Tpsa
120.66
Logp
3.238
H Acceptors
7
H Donors
1
Rotatable Bonds
4
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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: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₉H₂₅N₃O₆
Molecular Weight: 391.42
Synonyms: None
SMILES: CC(=O)O[C@@H]1[C@@H](NC(=O)OC(C)(C)C)C=C(C[C@H]1C)C2C(=CN=CC=2)[N+](=O)[O-]
Tpsa: 120.66
Logp: 3.238
H Acceptors: 7
H Donors: 1
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₉H₂₅N₃O₆
Molecular Weight:
391.42
Synonyms:
None
SMILES:
CC(=O)O[C@@H]1[C@@H](NC(=O)OC(C)(C)C)C=C(C[C@H]1C)C2C(=CN=CC=2)[N+](=O)[O-]
Tpsa:
120.66
Logp:
3.238
H Acceptors:
7
H Donors:
1
Rotatable Bonds:
4
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₇H₂₃N₃O₅
Molecular Weight: 349.38
Synonyms: None
SMILES: CC(C)(C)OC(=O)N[C@@H]1[C@@H](O)[C@H](C)CC(=C1)C2C(=CN=CC=2)[N+](=O)[O-]
Tpsa: 114.59
Logp: 2.6672
H Acceptors: 6
H Donors: 2
Rotatable Bonds: 3
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₇H₂₃N₃O₅
Molecular Weight:
349.38
Synonyms:
None
SMILES:
CC(C)(C)OC(=O)N[C@@H]1[C@@H](O)[C@H](C)CC(=C1)C2C(=CN=CC=2)[N+](=O)[O-]
Tpsa:
114.59
Logp:
2.6672
H Acceptors:
6
H Donors:
2
Rotatable Bonds:
3
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₃H₁₆N₂O₃
Molecular Weight: 248.28
Synonyms: None
SMILES: O=[N+]([O-])C1C(=CC=NC=1)C2CC(C)(C)CC(O)C=2
Tpsa: 76.26
Logp: 2.5541
H Acceptors: 4
H Donors: 1
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:
C₁₃H₁₆N₂O₃
Molecular Weight:
248.28
Synonyms:
None
SMILES:
O=[N+]([O-])C1C(=CC=NC=1)C2CC(C)(C)CC(O)C=2
Tpsa:
76.26
Logp:
2.5541
H Acceptors:
4
H Donors:
1
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: C₁₃H₁₄N₂O₃
Molecular Weight: 246.26
Synonyms: None
SMILES: O=[N+]([O-])C1C(=CC=NC=1)C2CC(C)(C)CC(=O)C=2
Tpsa: 73.1
Logp: 2.7623
H Acceptors: 4
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:
C₁₃H₁₄N₂O₃
Molecular Weight:
246.26
Synonyms:
None
SMILES:
O=[N+]([O-])C1C(=CC=NC=1)C2CC(C)(C)CC(=O)C=2
Tpsa:
73.1
Logp:
2.7623
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
2