CS-1079171
1-(Tert-butyl) 3-methyl (3R,6R)-6-(cyanomethyl)piperazine-1,3-dicarboxylate
Manufacturer: ChemScene
CAS Number: 2920178-66-9
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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
C₁₃H₂₁N₃O₄
Molecular Weight
283.32
Synonyms
None
SMILES
C(OC(C)(C)C)(=O)N1[C@H](CC#N)CN[C@@H](C(OC)=O)C1
Tpsa
91.66
Logp
0.65058
H Acceptors
6
H Donors
1
Rotatable Bonds
2
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: C₁₃H₂₁N₃O₄
Molecular Weight: 283.32
Synonyms: None
SMILES: C(OC(C)(C)C)(=O)N1[C@H](CC#N)CN[C@@H](C(OC)=O)C1
Tpsa: 91.66
Logp: 0.65058
H Acceptors: 6
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:
C₁₃H₂₁N₃O₄
Molecular Weight:
283.32
Synonyms:
None
SMILES:
C(OC(C)(C)C)(=O)N1[C@H](CC#N)CN[C@@H](C(OC)=O)C1
Tpsa:
91.66
Logp:
0.65058
H Acceptors:
6
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: C₈H₁₂N₂
Molecular Weight: 136.19
Synonyms: None
SMILES: N[C@H]1C=2C(=CN(C)C2)CC1
Tpsa: 30.95
Logp: 0.9711
H Acceptors: 2
H Donors: 1
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:
C₈H₁₂N₂
Molecular Weight:
136.19
Synonyms:
None
SMILES:
N[C@H]1C=2C(=CN(C)C2)CC1
Tpsa:
30.95
Logp:
0.9711
H Acceptors:
2
H Donors:
1
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: C₅H₈N₂OS
Molecular Weight: 144.19
Synonyms: None
SMILES: O=C1[C@@]2(N[C@@](SC2)(CN1)[H])[H]
Tpsa: 41.13
Logp: -0.8527
H Acceptors: 3
H Donors: 2
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:
C₅H₈N₂OS
Molecular Weight:
144.19
Synonyms:
None
SMILES:
O=C1[C@@]2(N[C@@](SC2)(CN1)[H])[H]
Tpsa:
41.13
Logp:
-0.8527
H Acceptors:
3
H Donors:
2
Rotatable Bonds:
0
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₁₅NO₂
Molecular Weight: 169.22
Synonyms: None
SMILES: C(OC)(=O)[C@H]1[C@]2(C[C@@](C1)(CNC2)[H])[H]
Tpsa: 38.33
Logp: 0.405
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 1
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₁₅NO₂
Molecular Weight:
169.22
Synonyms:
None
SMILES:
C(OC)(=O)[C@H]1[C@]2(C[C@@](C1)(CNC2)[H])[H]
Tpsa:
38.33
Logp:
0.405
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
1