CS-0798837
2-Chloro-5-[(3S)-3-hydroxytetrahydropyran-3-yl]benzoic acid
Manufacturer: ChemScene
CAS Number: 2845115-40-2
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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
C₁₂H₁₃ClO₄
Molecular Weight
256.68
Synonyms
None
SMILES
OC(=O)C1C=C(C=CC=1Cl)[C@]2(O)COCCC2
Tpsa
66.76
Logp
2.0362
H Acceptors
3
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: C₁₂H₁₃ClO₄
Molecular Weight: 256.68
Synonyms: None
SMILES: OC(=O)C1C=C(C=CC=1Cl)[C@]2(O)COCCC2
Tpsa: 66.76
Logp: 2.0362
H Acceptors: 3
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:
C₁₂H₁₃ClO₄
Molecular Weight:
256.68
Synonyms:
None
SMILES:
OC(=O)C1C=C(C=CC=1Cl)[C@]2(O)COCCC2
Tpsa:
66.76
Logp:
2.0362
H Acceptors:
3
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: C₁₁H₂₀N₂O₄
Molecular Weight: 244.29
Synonyms: None
SMILES: OC(=O)[C@@H]1CN(CCNC1)C(=O)OC(C)(C)C
Tpsa: 78.87
Logp: 0.5275
H Acceptors: 4
H Donors: 2
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:
C₁₁H₂₀N₂O₄
Molecular Weight:
244.29
Synonyms:
None
SMILES:
OC(=O)[C@@H]1CN(CCNC1)C(=O)OC(C)(C)C
Tpsa:
78.87
Logp:
0.5275
H Acceptors:
4
H Donors:
2
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: C₁₅H₁₆O₄
Molecular Weight: 260.29
Synonyms: None
SMILES: COC1=C2C(OCC=C2C(O)=O)=C(C=C1)C3CCC3
Tpsa: 55.76
Logp: 2.8231
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:
C₁₅H₁₆O₄
Molecular Weight:
260.29
Synonyms:
None
SMILES:
COC1=C2C(OCC=C2C(O)=O)=C(C=C1)C3CCC3
Tpsa:
55.76
Logp:
2.8231
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: C₁₄H₂₀N₄O₃
Molecular Weight: 292.33
Synonyms: None
SMILES: CO[C@@H](C)C1C2N(C=CN=2)N=CC=1NC(=O)OC(C)(C)C
Tpsa: 77.75
Logp: 2.7837
H Acceptors: 6
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:
C₁₄H₂₀N₄O₃
Molecular Weight:
292.33
Synonyms:
None
SMILES:
CO[C@@H](C)C1C2N(C=CN=2)N=CC=1NC(=O)OC(C)(C)C
Tpsa:
77.75
Logp:
2.7837
H Acceptors:
6
H Donors:
1
Rotatable Bonds:
3