CS-1051244
rel-(3S,4R)-Methyl 4-bromo-3-hydroxycyclohexanecarboxylate
Manufacturer: ChemScene
CAS Number: 3034111-46-8
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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
C₈H₁₃BrO₃
Molecular Weight
237.09
Synonyms
None
SMILES
C(OC)(=O)C1C[C@H](O)[C@H](Br)CC1
Tpsa
46.53
Logp
1.0839
H Acceptors
3
H Donors
1
Rotatable Bonds
1
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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: C₈H₁₃BrO₃
Molecular Weight: 237.09
Synonyms: None
SMILES: C(OC)(=O)C1C[C@H](O)[C@H](Br)CC1
Tpsa: 46.53
Logp: 1.0839
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:
C₈H₁₃BrO₃
Molecular Weight:
237.09
Synonyms:
None
SMILES:
C(OC)(=O)C1C[C@H](O)[C@H](Br)CC1
Tpsa:
46.53
Logp:
1.0839
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: C₇H₉BrO₂
Molecular Weight: 205.05
Synonyms: None
SMILES: Br[C@@H]1[C@]2(C[C@](C(=O)O2)(CC1)[H])[H]
Tpsa: 26.3
Logp: 1.4754
H Acceptors: 2
H Donors: 0
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇H₉BrO₂
Molecular Weight:
205.05
Synonyms:
None
SMILES:
Br[C@@H]1[C@]2(C[C@](C(=O)O2)(CC1)[H])[H]
Tpsa:
26.3
Logp:
1.4754
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
0
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₆BrN₃O₂
Molecular Weight: 256.06
Synonyms: None
SMILES: O=C1NC=2C=NC=C(Br)C2N(C1=O)C
Tpsa: 67.75
Logp: 0.3843
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₆BrN₃O₂
Molecular Weight:
256.06
Synonyms:
None
SMILES:
O=C1NC=2C=NC=C(Br)C2N(C1=O)C
Tpsa:
67.75
Logp:
0.3843
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
0
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₇ClN₂
Molecular Weight: 166.61
Synonyms: None
SMILES: ClC1=C(C=CC2=NC=CN21)C
Tpsa: 17.3
Logp: 2.29612
H Acceptors: 2
H Donors: 0
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₇ClN₂
Molecular Weight:
166.61
Synonyms:
None
SMILES:
ClC1=C(C=CC2=NC=CN21)C
Tpsa:
17.3
Logp:
2.29612
H Acceptors:
2
H Donors:
0
Rotatable Bonds:
0