CS-0766963
5,8-dihydroxy-3-methyl-3,4,4a,5,6,7-hexahydro-1H-isochromen-1-one
Manufacturer: ChemScene
CAS Number: 1212375-18-2
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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
C₁₀H₁₄O₄
Molecular Weight
198.22
Synonyms
None
SMILES
O=C1OC(CC2C1=C(CCC2O)O)C
Tpsa
66.76
Logp
0.9048
H Acceptors
4
H Donors
2
Rotatable Bonds
0
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: C₁₀H₁₄O₄
Molecular Weight: 198.22
Synonyms: None
SMILES: O=C1OC(CC2C1=C(CCC2O)O)C
Tpsa: 66.76
Logp: 0.9048
H Acceptors: 4
H Donors: 2
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:
C₁₀H₁₄O₄
Molecular Weight:
198.22
Synonyms:
None
SMILES:
O=C1OC(CC2C1=C(CCC2O)O)C
Tpsa:
66.76
Logp:
0.9048
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
0
Purity: ≥95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₆H₄BrN₃O
Molecular Weight: 214.02
Synonyms: None
SMILES: BrC1=NNC2=C1NC(=O)C=C2
Tpsa: 61.54
Logp: 1.0137
H Acceptors: 2
H Donors: 2
Rotatable Bonds: 0
Purity:
≥95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₆H₄BrN₃O
Molecular Weight:
214.02
Synonyms:
None
SMILES:
BrC1=NNC2=C1NC(=O)C=C2
Tpsa:
61.54
Logp:
1.0137
H Acceptors:
2
H Donors:
2
Rotatable Bonds:
0
Purity: ≥95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₁₀ClN₃
Molecular Weight: 171.63
Synonyms: None
SMILES: CCNCC1=C(Cl)N=CC=N1
Tpsa: 37.81
Logp: 1.2395
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 3
Purity:
≥95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇H₁₀ClN₃
Molecular Weight:
171.63
Synonyms:
None
SMILES:
CCNCC1=C(Cl)N=CC=N1
Tpsa:
37.81
Logp:
1.2395
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
3
Purity: ≥95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₅H₈F₃NO₃S
Molecular Weight: 219.18
Synonyms: None
SMILES: FC(F)(F)S(=O)(=O)O[C@@H]1CCNC1
Tpsa: 55.4
Logp: 0.2145
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 2
Purity:
≥95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₅H₈F₃NO₃S
Molecular Weight:
219.18
Synonyms:
None
SMILES:
FC(F)(F)S(=O)(=O)O[C@@H]1CCNC1
Tpsa:
55.4
Logp:
0.2145
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
2