CS-0372974
3-(3-Chlorophenyl)-3-oxopropanoic acid
Manufacturer: ChemScene
CAS Number: 13422-80-5
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Purity
98%
MDL No
MFCD06208143
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₉H₇ClO₃
Molecular Weight
198.60
Synonyms
m-Chlorbenzoylessigsaeure
SMILES
O=C(CC(C1=CC(Cl)=CC=C1)=O)O
Tpsa
54.37
Logp
1.9974
H Acceptors
2
H Donors
1
Rotatable Bonds
3
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: MFCD06208143
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₇ClO₃
Molecular Weight: 198.60
Synonyms: m-Chlorbenzoylessigsaeure
SMILES: O=C(CC(C1=CC(Cl)=CC=C1)=O)O
Tpsa: 54.37
Logp: 1.9974
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 3
Purity:
98%
MDL No:
MFCD06208143
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₇ClO₃
Molecular Weight:
198.60
Synonyms:
m-Chlorbenzoylessigsaeure
SMILES:
O=C(CC(C1=CC(Cl)=CC=C1)=O)O
Tpsa:
54.37
Logp:
1.9974
H Acceptors:
2
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: C₂₂H₂₇BO₆
Molecular Weight: 398.26
Synonyms: None
SMILES: O=C(OC)C1=CC(OCC2=CC=CC=C2)=C(OC)C=C1B3OC(C)(C)C(C)(C)O3
Tpsa: 63.22
Logp: 3.36
H Acceptors: 6
H Donors: 0
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:
C₂₂H₂₇BO₆
Molecular Weight:
398.26
Synonyms:
None
SMILES:
O=C(OC)C1=CC(OCC2=CC=CC=C2)=C(OC)C=C1B3OC(C)(C)C(C)(C)O3
Tpsa:
63.22
Logp:
3.36
H Acceptors:
6
H Donors:
0
Rotatable Bonds:
6
Purity: 96%
MDL No: MFCD01631983
Storage: Store at room temperature
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₁H₂₁NO₆
Molecular Weight: 383.39
Synonyms: N-ALPHA-(9-FLUORENYLMETHOXYCARBONYL)-ALPHA-L-AMINOADIPIC ACID
SMILES: O=C(O)[C@@H](NC(OCC1C2=C(C3=C1C=CC=C3)C=CC=C2)=O)CCCC(O)=O
Tpsa: 112.93
Logp: 3.2332
H Acceptors: 4
H Donors: 3
Rotatable Bonds: 8
Purity:
96%
MDL No:
MFCD01631983
Storage:
Store at room temperature
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₁H₂₁NO₆
Molecular Weight:
383.39
Synonyms:
N-ALPHA-(9-FLUORENYLMETHOXYCARBONYL)-ALPHA-L-AMINOADIPIC ACID
SMILES:
O=C(O)[C@@H](NC(OCC1C2=C(C3=C1C=CC=C3)C=CC=C2)=O)CCCC(O)=O
Tpsa:
112.93
Logp:
3.2332
H Acceptors:
4
H Donors:
3
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: C₁₆H₁₉NO₄
Molecular Weight: 289.33
Synonyms: ethyl 4-hydroxy-1-(2-methylpropyl)-2-oxo-1,2-dihydro-3-quinolinecarboxylate
SMILES: O=C(C1=C(O)C2=C(N(CC(C)C)C1=O)C=CC=C2)OCC
Tpsa: 68.53
Logp: 2.5398
H Acceptors: 5
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:
C₁₆H₁₉NO₄
Molecular Weight:
289.33
Synonyms:
ethyl 4-hydroxy-1-(2-methylpropyl)-2-oxo-1,2-dihydro-3-quinolinecarboxylate
SMILES:
O=C(C1=C(O)C2=C(N(CC(C)C)C1=O)C=CC=C2)OCC
Tpsa:
68.53
Logp:
2.5398
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
4