CS-1172767
3-(4-Bromophenyl)-2-((tert-butoxycarbonyl)amino)-3,3-difluoropropanoic acid
Manufacturer: ChemScene
CAS Number: 2231290-72-3
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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
C₁₄H₁₆BrF₂NO₄
Molecular Weight
380.18
Synonyms
None
SMILES
O=C(NC(C(F)(C1=CC=C(C=C1)Br)F)C(O)=O)OC(C)(C)C
Tpsa
75.63
Logp
3.5188
H Acceptors
3
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: C₁₄H₁₆BrF₂NO₄
Molecular Weight: 380.18
Synonyms: None
SMILES: O=C(NC(C(F)(C1=CC=C(C=C1)Br)F)C(O)=O)OC(C)(C)C
Tpsa: 75.63
Logp: 3.5188
H Acceptors: 3
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:
C₁₄H₁₆BrF₂NO₄
Molecular Weight:
380.18
Synonyms:
None
SMILES:
O=C(NC(C(F)(C1=CC=C(C=C1)Br)F)C(O)=O)OC(C)(C)C
Tpsa:
75.63
Logp:
3.5188
H Acceptors:
3
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: C₇H₁₄ClN
Molecular Weight: 147.65
Synonyms: None
SMILES: NCC12CCC1CC2.Cl
Tpsa: 26.02
Logp: 1.5571
H Acceptors: 1
H Donors: 1
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:
C₇H₁₄ClN
Molecular Weight:
147.65
Synonyms:
None
SMILES:
NCC12CCC1CC2.Cl
Tpsa:
26.02
Logp:
1.5571
H Acceptors:
1
H Donors:
1
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: C₆H₈LiNO₂
Molecular Weight: 133.07
Synonyms: None
SMILES: O=C([C@H]1N[C@@H]1C2CC2)[O-].[Li+]
Tpsa: 62.07
Logp: -4.5093
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:
C₆H₈LiNO₂
Molecular Weight:
133.07
Synonyms:
None
SMILES:
O=C([C@H]1N[C@@H]1C2CC2)[O-].[Li+]
Tpsa:
62.07
Logp:
-4.5093
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: C₇H₁₁F₂NO₂
Molecular Weight: 179.16
Synonyms: None
SMILES: O=C(OC)C(N)C1(C(F)F)CC1
Tpsa: 52.32
Logp: 0.532
H Acceptors: 3
H Donors: 1
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:
C₇H₁₁F₂NO₂
Molecular Weight:
179.16
Synonyms:
None
SMILES:
O=C(OC)C(N)C1(C(F)F)CC1
Tpsa:
52.32
Logp:
0.532
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
3