CS-0803811
[rel-(1R,2R,6R)-2-(tert-butoxycarbonylamino)-6-methyl-4-(3-nitro-4-pyridyl)cyclohex-3-en-1-yl] methanesulfonate
Manufacturer: ChemScene
CAS Number: 1210418-16-8
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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
C₁₈H₂₅N₃O₇S
Molecular Weight
427.47
Synonyms
None
SMILES
CC(C)(C)OC(=O)N[C@H]1[C@H](OS(=O)(C)=O)[C@H](C)CC(=C1)C2C(=CN=CC=2)[N+](=O)[O-]
Tpsa
137.73
Logp
2.6511
H Acceptors
8
H Donors
1
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: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₈H₂₅N₃O₇S
Molecular Weight: 427.47
Synonyms: None
SMILES: CC(C)(C)OC(=O)N[C@H]1[C@H](OS(=O)(C)=O)[C@H](C)CC(=C1)C2C(=CN=CC=2)[N+](=O)[O-]
Tpsa: 137.73
Logp: 2.6511
H Acceptors: 8
H Donors: 1
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:
C₁₈H₂₅N₃O₇S
Molecular Weight:
427.47
Synonyms:
None
SMILES:
CC(C)(C)OC(=O)N[C@H]1[C@H](OS(=O)(C)=O)[C@H](C)CC(=C1)C2C(=CN=CC=2)[N+](=O)[O-]
Tpsa:
137.73
Logp:
2.6511
H Acceptors:
8
H Donors:
1
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: 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: C₁₈H₃₀N₂OSi
Molecular Weight: 318.53
Synonyms: None
SMILES: NC1C(=CC=NC=1)C2=C[C@H](C[C@@H](C)C2)O[Si](C)(C)C(C)(C)C
Tpsa: 48.14
Logp: 4.8675
H Acceptors: 3
H Donors: 1
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:
C₁₈H₃₀N₂OSi
Molecular Weight:
318.53
Synonyms:
None
SMILES:
NC1C(=CC=NC=1)C2=C[C@H](C[C@@H](C)C2)O[Si](C)(C)C(C)(C)C
Tpsa:
48.14
Logp:
4.8675
H Acceptors:
3
H Donors:
1
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: C₁₇H₂₃N₃O₄
Molecular Weight: 333.38
Synonyms: None
SMILES: CC(C)(C)OC(=O)N1C2C(CCC(C3C(N)=CN=CC=3)C2)OC1=O
Tpsa: 94.75
Logp: 3.0558
H Acceptors: 6
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:
C₁₇H₂₃N₃O₄
Molecular Weight:
333.38
Synonyms:
None
SMILES:
CC(C)(C)OC(=O)N1C2C(CCC(C3C(N)=CN=CC=3)C2)OC1=O
Tpsa:
94.75
Logp:
3.0558
H Acceptors:
6
H Donors:
1
Rotatable Bonds:
1