CS-1153966
4,5-Dimethyl-7-(2-methylprop-1-en-1-yl)-3a,4,7,7a-tetrahydroisobenzofuran-1,3-dione
Manufacturer: ChemScene
CAS Number: 7672-77-7
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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
C₁₄H₁₈O₃
Molecular Weight
234.30
Synonyms
None
SMILES
O=C1OC(=O)C2C(C(=CC(C=C(C)C)C12)C)C
Tpsa
43.37
Logp
2.4806
H Acceptors
3
H Donors
0
Rotatable Bonds
1
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: C₁₄H₁₈O₃
Molecular Weight: 234.30
Synonyms: None
SMILES: O=C1OC(=O)C2C(C(=CC(C=C(C)C)C12)C)C
Tpsa: 43.37
Logp: 2.4806
H Acceptors: 3
H Donors: 0
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:
C₁₄H₁₈O₃
Molecular Weight:
234.30
Synonyms:
None
SMILES:
O=C1OC(=O)C2C(C(=CC(C=C(C)C)C12)C)C
Tpsa:
43.37
Logp:
2.4806
H Acceptors:
3
H Donors:
0
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: C₆H₆N₂O₃
Molecular Weight: 154.13
Synonyms: None
SMILES: O=CC1=CC(=CN1C)N(=O)=O
Tpsa: 65.14
Logp: 0.7458
H Acceptors: 4
H Donors: 0
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:
C₆H₆N₂O₃
Molecular Weight:
154.13
Synonyms:
None
SMILES:
O=CC1=CC(=CN1C)N(=O)=O
Tpsa:
65.14
Logp:
0.7458
H Acceptors:
4
H Donors:
0
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: C₁₂H₁₃N
Molecular Weight: 171.24
Synonyms: None
SMILES: N#CC(C=C)(C)CC=1C=CC=CC1
Tpsa: 23.79
Logp: 2.94498
H Acceptors: 1
H Donors: 0
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:
C₁₂H₁₃N
Molecular Weight:
171.24
Synonyms:
None
SMILES:
N#CC(C=C)(C)CC=1C=CC=CC1
Tpsa:
23.79
Logp:
2.94498
H Acceptors:
1
H Donors:
0
Rotatable Bonds:
3
Purity: 97%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₁₀N₄S
Molecular Weight: 218.28
Synonyms: None
SMILES: N=1C(=NC(=NC1N)C=2C=CC=CC2)SC
Tpsa: 64.69
Logp: 1.8427
H Acceptors: 5
H Donors: 1
Rotatable Bonds: 2
Purity:
97%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₀H₁₀N₄S
Molecular Weight:
218.28
Synonyms:
None
SMILES:
N=1C(=NC(=NC1N)C=2C=CC=CC2)SC
Tpsa:
64.69
Logp:
1.8427
H Acceptors:
5
H Donors:
1
Rotatable Bonds:
2