CS-1174096
4-Acetamido-2-bromo-3-fluorobenzoic acid
Manufacturer: ChemScene
CAS Number: 2680733-03-1
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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
C₉H₇BrFNO₃
Molecular Weight
276.06
Synonyms
None
SMILES
O=C(O)C1=CC=C(NC(C)=O)C(F)=C1Br
Tpsa
66.4
Logp
2.2448
H Acceptors
2
H Donors
2
Rotatable Bonds
2
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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: C₉H₇BrFNO₃
Molecular Weight: 276.06
Synonyms: None
SMILES: O=C(O)C1=CC=C(NC(C)=O)C(F)=C1Br
Tpsa: 66.4
Logp: 2.2448
H Acceptors: 2
H Donors: 2
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:
C₉H₇BrFNO₃
Molecular Weight:
276.06
Synonyms:
None
SMILES:
O=C(O)C1=CC=C(NC(C)=O)C(F)=C1Br
Tpsa:
66.4
Logp:
2.2448
H Acceptors:
2
H Donors:
2
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: C₅H₉ClN₂O
Molecular Weight: 148.59
Synonyms: None
SMILES: N#CC1CC(C1)ON.Cl
Tpsa: 59.04
Logp: 0.60068
H Acceptors: 3
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:
C₅H₉ClN₂O
Molecular Weight:
148.59
Synonyms:
None
SMILES:
N#CC1CC(C1)ON.Cl
Tpsa:
59.04
Logp:
0.60068
H Acceptors:
3
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: C₈H₇BrO
Molecular Weight: 199.04
Synonyms: None
SMILES: OC1=C(Br)C=C2CCC2=C1
Tpsa: 20.23
Logp: 2.2533
H Acceptors: 1
H Donors: 1
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₇BrO
Molecular Weight:
199.04
Synonyms:
None
SMILES:
OC1=C(Br)C=C2CCC2=C1
Tpsa:
20.23
Logp:
2.2533
H Acceptors:
1
H Donors:
1
Rotatable Bonds:
0
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₃₇H₅₇N₇O₈
Molecular Weight: 727.89
Synonyms: None
SMILES: O=C1N2[C@](CCC2)([H])C(N[C@H](C(N[C@@](C(N[C@H](C(NCC(N[C@@](C(N[C@@]1([H])[C@H](O)C)=O)([H])[C@@H](C)CC)=O)=O)CC3=CC=CC=C3)=O)([H])[C@@H](C)CC)=O)C(C)C)=O
Tpsa: N/A
Logp: N/A
H Acceptors: N/A
H Donors: N/A
Rotatable Bonds: N/A
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₃₇H₅₇N₇O₈
Molecular Weight:
727.89
Synonyms:
None
SMILES:
O=C1N2[C@](CCC2)([H])C(N[C@H](C(N[C@@](C(N[C@H](C(NCC(N[C@@](C(N[C@@]1([H])[C@H](O)C)=O)([H])[C@@H](C)CC)=O)=O)CC3=CC=CC=C3)=O)([H])[C@@H](C)CC)=O)C(C)C)=O
Tpsa:
N/A
Logp:
N/A
H Acceptors:
N/A
H Donors:
N/A
Rotatable Bonds:
N/A