CS-0618221
5-Bromo-2-methyl-3-pivalamidobenzoic acid
Manufacturer: ChemScene
CAS Number: 2176700-56-2
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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
C₁₃H₁₆BrNO₃
Molecular Weight
314.18
Synonyms
None
SMILES
O=C(O)C1=CC(Br)=CC(NC(C(C)(C)C)=O)=C1C
Tpsa
66.4
Logp
3.44032
H Acceptors
2
H Donors
2
Rotatable Bonds
2
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: C₁₃H₁₆BrNO₃
Molecular Weight: 314.18
Synonyms: None
SMILES: O=C(O)C1=CC(Br)=CC(NC(C(C)(C)C)=O)=C1C
Tpsa: 66.4
Logp: 3.44032
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:
C₁₃H₁₆BrNO₃
Molecular Weight:
314.18
Synonyms:
None
SMILES:
O=C(O)C1=CC(Br)=CC(NC(C(C)(C)C)=O)=C1C
Tpsa:
66.4
Logp:
3.44032
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: C₁₅H₂₃BO₄
Molecular Weight: 278.15
Synonyms: None
SMILES: CC1(C)C(C)(C)OB(C2=CC(OCOC)=CC=C2C)O1
Tpsa: 36.92
Logp: 2.27692
H Acceptors: 4
H Donors: 0
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:
C₁₅H₂₃BO₄
Molecular Weight:
278.15
Synonyms:
None
SMILES:
CC1(C)C(C)(C)OB(C2=CC(OCOC)=CC=C2C)O1
Tpsa:
36.92
Logp:
2.27692
H Acceptors:
4
H Donors:
0
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: C₈H₂Cl₂F₃N₃
Molecular Weight: 268.02
Synonyms: None
SMILES: FC1=C(Cl)N=CC2=C(Cl)N=C(C(F)F)N=C21
Tpsa: 38.67
Logp: 3.4083
H Acceptors: 3
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:
C₈H₂Cl₂F₃N₃
Molecular Weight:
268.02
Synonyms:
None
SMILES:
FC1=C(Cl)N=CC2=C(Cl)N=C(C(F)F)N=C21
Tpsa:
38.67
Logp:
3.4083
H Acceptors:
3
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: C₈H₃ClF₃N₃O
Molecular Weight: 249.58
Synonyms: None
SMILES: O=C1C(C=NC(Cl)=C2F)=C2N=C(C(F)F)N1
Tpsa: 58.64
Logp: 2.0482
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:
C₈H₃ClF₃N₃O
Molecular Weight:
249.58
Synonyms:
None
SMILES:
O=C1C(C=NC(Cl)=C2F)=C2N=C(C(F)F)N1
Tpsa:
58.64
Logp:
2.0482
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
1