CS-0867900
(S)-2-((tert-Butoxycarbonyl)amino)-3-(3,4-dioxocyclohexa-1,5-dien-1-yl)propanoic acid
Manufacturer: ChemScene
CAS Number: 122861-06-7
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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
C₁₄H₁₇NO₆
Molecular Weight
295.29
Synonyms
None
SMILES
CC(C)(C)OC(N[C@H](C(O)=O)CC1=CC(C(C=C1)=O)=O)=O
Tpsa
109.77
Logp
0.9888
H Acceptors
5
H Donors
2
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: C₁₄H₁₇NO₆
Molecular Weight: 295.29
Synonyms: None
SMILES: CC(C)(C)OC(N[C@H](C(O)=O)CC1=CC(C(C=C1)=O)=O)=O
Tpsa: 109.77
Logp: 0.9888
H Acceptors: 5
H Donors: 2
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:
C₁₄H₁₇NO₆
Molecular Weight:
295.29
Synonyms:
None
SMILES:
CC(C)(C)OC(N[C@H](C(O)=O)CC1=CC(C(C=C1)=O)=O)=O
Tpsa:
109.77
Logp:
0.9888
H Acceptors:
5
H Donors:
2
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: C₁₅H₁₈F₃NO₄
Molecular Weight: 333.30
Synonyms: None
SMILES: O=C(O)[C@H](CC1=CC=C(OC(C)(C)C)C=C1)NC(C(F)(F)F)=O
Tpsa: 75.63
Logp: 2.5381
H Acceptors: 3
H Donors: 2
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:
C₁₅H₁₈F₃NO₄
Molecular Weight:
333.30
Synonyms:
None
SMILES:
O=C(O)[C@H](CC1=CC=C(OC(C)(C)C)C=C1)NC(C(F)(F)F)=O
Tpsa:
75.63
Logp:
2.5381
H Acceptors:
3
H Donors:
2
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: C₇H₅N₃O₃
Molecular Weight: 179.13
Synonyms: None
SMILES: COC1=C([N+]([O-])=O)C=CC(C#N)=N1
Tpsa: 89.05
Logp: 0.87008
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:
C₇H₅N₃O₃
Molecular Weight:
179.13
Synonyms:
None
SMILES:
COC1=C([N+]([O-])=O)C=CC(C#N)=N1
Tpsa:
89.05
Logp:
0.87008
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: C₈H₇N₃O₃
Molecular Weight: 193.16
Synonyms: None
SMILES: CCOC1=C([N+]([O-])=O)C=CC(C#N)=N1
Tpsa: 89.05
Logp: 1.26018
H Acceptors: 5
H Donors: 0
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:
C₈H₇N₃O₃
Molecular Weight:
193.16
Synonyms:
None
SMILES:
CCOC1=C([N+]([O-])=O)C=CC(C#N)=N1
Tpsa:
89.05
Logp:
1.26018
H Acceptors:
5
H Donors:
0
Rotatable Bonds:
3