CS-0744539
3,3-Dimethyl-4-(3-Nitro-phenyl)-4-oxo-butyric acid
Manufacturer: ChemScene
CAS Number: 483323-77-9
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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
C₁₂H₁₃NO₅
Molecular Weight
251.24
Synonyms
None
SMILES
CC(C)(CC(O)=O)C(=O)C1=CC(=CC=C1)[N+]([O-])=O
Tpsa
97.51
Logp
2.2784
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: C₁₂H₁₃NO₅
Molecular Weight: 251.24
Synonyms: None
SMILES: CC(C)(CC(O)=O)C(=O)C1=CC(=CC=C1)[N+]([O-])=O
Tpsa: 97.51
Logp: 2.2784
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:
C₁₂H₁₃NO₅
Molecular Weight:
251.24
Synonyms:
None
SMILES:
CC(C)(CC(O)=O)C(=O)C1=CC(=CC=C1)[N+]([O-])=O
Tpsa:
97.51
Logp:
2.2784
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: C₁₃H₁₈Cl₂N₂O₃S
Molecular Weight: 353.26
Synonyms: None
SMILES: CCCN(CCC)C(=O)NC1=CC(Cl)=C(C=C1)S(Cl)(=O)=O
Tpsa: 66.48
Logp: 3.9214
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 6
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₁₈Cl₂N₂O₃S
Molecular Weight:
353.26
Synonyms:
None
SMILES:
CCCN(CCC)C(=O)NC1=CC(Cl)=C(C=C1)S(Cl)(=O)=O
Tpsa:
66.48
Logp:
3.9214
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
6
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₅H₁₇ClN₂O₃S
Molecular Weight: 340.83
Synonyms: None
SMILES: CCN(CC)C(=O)NC1=C2C=CC=C(C2=CC=C1)S(Cl)(=O)=O
Tpsa: 66.48
Logp: 3.641
H Acceptors: 3
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:
C₁₅H₁₇ClN₂O₃S
Molecular Weight:
340.83
Synonyms:
None
SMILES:
CCN(CC)C(=O)NC1=C2C=CC=C(C2=CC=C1)S(Cl)(=O)=O
Tpsa:
66.48
Logp:
3.641
H Acceptors:
3
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: C₁₅H₂₂Cl₂N₂O₃S
Molecular Weight: 381.32
Synonyms: None
SMILES: CCCCN(CCCC)C(=O)NC1=CC(Cl)=C(C=C1)S(Cl)(=O)=O
Tpsa: 66.48
Logp: 4.7016
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 8
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₅H₂₂Cl₂N₂O₃S
Molecular Weight:
381.32
Synonyms:
None
SMILES:
CCCCN(CCCC)C(=O)NC1=CC(Cl)=C(C=C1)S(Cl)(=O)=O
Tpsa:
66.48
Logp:
4.7016
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
8