CS-1176311
Ethyl (S)-3-(5-bromo-2-fluorophenyl)-3-((tert-butoxycarbonyl)amino)propanoate
Manufacturer: ChemScene
CAS Number: 3047838-10-5
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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
C₁₆H₂₁BrFNO₄
Molecular Weight
390.24
Synonyms
None
SMILES
O=C(OCC)C[C@H](NC(OC(C)(C)C)=O)C1=CC(Br)=CC=C1F
Tpsa
64.63
Logp
4.1072
H Acceptors
4
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: C₁₆H₂₁BrFNO₄
Molecular Weight: 390.24
Synonyms: None
SMILES: O=C(OCC)C[C@H](NC(OC(C)(C)C)=O)C1=CC(Br)=CC=C1F
Tpsa: 64.63
Logp: 4.1072
H Acceptors: 4
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:
C₁₆H₂₁BrFNO₄
Molecular Weight:
390.24
Synonyms:
None
SMILES:
O=C(OCC)C[C@H](NC(OC(C)(C)C)=O)C1=CC(Br)=CC=C1F
Tpsa:
64.63
Logp:
4.1072
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
5
Purity: 95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₅H₂₃BO₃
Molecular Weight: 262.15
Synonyms: None
SMILES: CC1(C)C(C)(C)OB(C2=C(C)C=C(C)C=C2OC)O1
Tpsa: 27.69
Logp: 2.61124
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 2
Purity:
95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₅H₂₃BO₃
Molecular Weight:
262.15
Synonyms:
None
SMILES:
CC1(C)C(C)(C)OB(C2=C(C)C=C(C)C=C2OC)O1
Tpsa:
27.69
Logp:
2.61124
H Acceptors:
3
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: C₆H₁₂N₂O₂
Molecular Weight: 144.17
Synonyms: None
SMILES: O=C([C@@H]1NC[C@H](N)CC1)O
Tpsa: 75.35
Logp: -0.8497
H Acceptors: 3
H Donors: 3
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:
C₆H₁₂N₂O₂
Molecular Weight:
144.17
Synonyms:
None
SMILES:
O=C([C@@H]1NC[C@H](N)CC1)O
Tpsa:
75.35
Logp:
-0.8497
H Acceptors:
3
H Donors:
3
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: C₆H₇F₂NOS
Molecular Weight: 179.19
Synonyms: None
SMILES: OCC1=CN=C(C(F)(F)C)S1
Tpsa: 33.12
Logp: 1.7471
H Acceptors: 3
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:
C₆H₇F₂NOS
Molecular Weight:
179.19
Synonyms:
None
SMILES:
OCC1=CN=C(C(F)(F)C)S1
Tpsa:
33.12
Logp:
1.7471
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
2