CS-0497927
(S)-Methyl 2-((tert-butoxycarbonyl)amino)-3-(4-chlorophenyl)propanoate
Manufacturer: ChemScene
CAS Number: 172035-26-6
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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
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
Related Products
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: 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
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₆H₁₈N₂O₄S
Molecular Weight: 334.39
Synonyms: Benzylpenillic acid
SMILES: O=C(C1N(C(CC2=CC=CC=C2)=NC3C(O)=O)C3SC1(C)C)O
Tpsa: 90.2
Logp: 1.7011
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:
C₁₆H₁₈N₂O₄S
Molecular Weight:
334.39
Synonyms:
Benzylpenillic acid
SMILES:
O=C(C1N(C(CC2=CC=CC=C2)=NC3C(O)=O)C3SC1(C)C)O
Tpsa:
90.2
Logp:
1.7011
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: C₁₁H₁₂N₆O₄S
Molecular Weight: 324.32
Synonyms: None
SMILES: OC(C1=C(C)CS[C@@]([C@@H]2NC(CN3C=NN=N3)=O)([H])N1C2=O)=O
Tpsa: 130.31
Logp: -1.5684
H Acceptors: 8
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:
C₁₁H₁₂N₆O₄S
Molecular Weight:
324.32
Synonyms:
None
SMILES:
OC(C1=C(C)CS[C@@]([C@@H]2NC(CN3C=NN=N3)=O)([H])N1C2=O)=O
Tpsa:
130.31
Logp:
-1.5684
H Acceptors:
8
H Donors:
2
Rotatable Bonds:
4