CS-0173572
Benzyl (S)-3-hydroxybutanoate
Manufacturer: ChemScene
CAS Number: 127604-17-5
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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
C₁₁H₁₄O₃
Molecular Weight
194.23
Synonyms
benzyl (3S)-3-hydroxybutanoate
SMILES
C[C@H](O)CC(OCC1=CC=CC=C1)=O
Tpsa
46.53
Logp
1.5007
H Acceptors
3
H Donors
1
Rotatable Bonds
4
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: C₁₁H₁₄O₃
Molecular Weight: 194.23
Synonyms: benzyl (3S)-3-hydroxybutanoate
SMILES: C[C@H](O)CC(OCC1=CC=CC=C1)=O
Tpsa: 46.53
Logp: 1.5007
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:
C₁₁H₁₄O₃
Molecular Weight:
194.23
Synonyms:
benzyl (3S)-3-hydroxybutanoate
SMILES:
C[C@H](O)CC(OCC1=CC=CC=C1)=O
Tpsa:
46.53
Logp:
1.5007
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: C₃₁H₄₄N₄O₄
Molecular Weight: 536.71
Synonyms: None
SMILES: CC1=CC=CC(C)=C1NC([C@@H]2CCCC[N@@+]2([O-])CCC[N@+]3([O-])CCCC[C@H]3C(NC4=C(C)C=CC=C4C)=O)=O
Tpsa: 104.32
Logp: 5.62178
H Acceptors: 4
H Donors: 2
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:
C₃₁H₄₄N₄O₄
Molecular Weight:
536.71
Synonyms:
None
SMILES:
CC1=CC=CC(C)=C1NC([C@@H]2CCCC[N@@+]2([O-])CCC[N@+]3([O-])CCCC[C@H]3C(NC4=C(C)C=CC=C4C)=O)=O
Tpsa:
104.32
Logp:
5.62178
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
8
Purity: 98%
MDL No: None
Storage: -20°C
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₃₉H₆₀N₄O₄
Molecular Weight: 648.92
Synonyms: None
SMILES: O=C([C@@H]1CCCC[N@@+]1([O-])CCC[N@+]2([O-])CCCC[C@H]2C(NC3=C(C(C)C)C=CC=C3C(C)C)=O)NC4=C(C(C)C)C=CC=C4C(C)C
Tpsa: 104.32
Logp: 8.8817
H Acceptors: 4
H Donors: 2
Rotatable Bonds: 12
Purity:
98%
MDL No:
None
Storage:
-20°C
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₃₉H₆₀N₄O₄
Molecular Weight:
648.92
Synonyms:
None
SMILES:
O=C([C@@H]1CCCC[N@@+]1([O-])CCC[N@+]2([O-])CCCC[C@H]2C(NC3=C(C(C)C)C=CC=C3C(C)C)=O)NC4=C(C(C)C)C=CC=C4C(C)C
Tpsa:
104.32
Logp:
8.8817
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
12
Purity: 98%
MDL No: None
Storage: 4°C
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇HCl₂N₃
Molecular Weight: 198.01
Synonyms: None
SMILES: N#CC1=CC(C#N)=C(Cl)N=C1Cl
Tpsa: 60.47
Logp: 2.13176
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
4°C
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇HCl₂N₃
Molecular Weight:
198.01
Synonyms:
None
SMILES:
N#CC1=CC(C#N)=C(Cl)N=C1Cl
Tpsa:
60.47
Logp:
2.13176
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
0