CS-0497923
(S)-2-tert-Butyl 3-methyl 7-chloro-3,4-dihydroisoquinoline-2,3(1H)-dicarboxylate
Manufacturer: ChemScene
CAS Number: None
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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
C₁₆H₂₀ClNO₄
Molecular Weight
325.79
Synonyms
None
SMILES
CC(C)(C)OC(N1[C@H](C(OC)=O)CC2=C(C=C(Cl)C=C2)C1)=O
Tpsa
55.84
Logp
3.1748
H Acceptors
4
H Donors
0
Rotatable Bonds
1
Other Options
...
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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: C₁₆H₂₀ClNO₄
Molecular Weight: 325.79
Synonyms: None
SMILES: CC(C)(C)OC(N1[C@H](C(OC)=O)CC2=C(C=C(Cl)C=C2)C1)=O
Tpsa: 55.84
Logp: 3.1748
H Acceptors: 4
H Donors: 0
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:
C₁₆H₂₀ClNO₄
Molecular Weight:
325.79
Synonyms:
None
SMILES:
CC(C)(C)OC(N1[C@H](C(OC)=O)CC2=C(C=C(Cl)C=C2)C1)=O
Tpsa:
55.84
Logp:
3.1748
H Acceptors:
4
H Donors:
0
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: C₁₆H₁₈N₂O₅S
Molecular Weight: 350.39
Synonyms: Penicillin X
SMILES: O=C(N[C@@]1([H])[C@](SC(C)(C)[C@]2([H])C(O)=O)([H])N2C1=O)CC3=CC=C(O)C=C3
Tpsa: 106.94
Logp: 0.5664
H Acceptors: 5
H Donors: 3
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:
C₁₆H₁₈N₂O₅S
Molecular Weight:
350.39
Synonyms:
Penicillin X
SMILES:
O=C(N[C@@]1([H])[C@](SC(C)(C)[C@]2([H])C(O)=O)([H])N2C1=O)CC3=CC=C(O)C=C3
Tpsa:
106.94
Logp:
0.5664
H Acceptors:
5
H Donors:
3
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: C₁₅H₂₀ClNO₄
Molecular Weight: 313.78
Synonyms: None
SMILES: O=C(OC)[C@H](CC1=CC=C(Cl)C=C1)NC(OC(C)(C)C)=O
Tpsa: 64.63
Logp: 2.9488
H Acceptors: 4
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:
C₁₅H₂₀ClNO₄
Molecular Weight:
313.78
Synonyms:
None
SMILES:
O=C(OC)[C@H](CC1=CC=C(Cl)C=C1)NC(OC(C)(C)C)=O
Tpsa:
64.63
Logp:
2.9488
H Acceptors:
4
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: C₁₆H₂₀N₄O₄S₃
Molecular Weight: 428.55
Synonyms: None
SMILES: OC(C1=C(CSC2=NN=C(C)S2)CS[C@@]([C@@H]3NC(C(C)(C)C)=O)([H])N1C3=O)=O
Tpsa: 112.49
Logp: 1.72332
H Acceptors: 8
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:
C₁₆H₂₀N₄O₄S₃
Molecular Weight:
428.55
Synonyms:
None
SMILES:
OC(C1=C(CSC2=NN=C(C)S2)CS[C@@]([C@@H]3NC(C(C)(C)C)=O)([H])N1C3=O)=O
Tpsa:
112.49
Logp:
1.72332
H Acceptors:
8
H Donors:
2
Rotatable Bonds:
5