CS-0529842
2-(tert-Butyl) 3-methyl 5-chloro-6-methoxy-3,4-dihydroisoquinoline-2,3(1H)-dicarboxylate
Manufacturer: ChemScene
CAS Number: 2766799-98-6
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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
C₁₇H₂₂ClNO₅
Molecular Weight
355.81
Synonyms
None
SMILES
O=C(N1CC2=C(C(Cl)=C(OC)C=C2)CC1C(OC)=O)OC(C)(C)C
Tpsa
65.07
Logp
3.1834
H Acceptors
5
H Donors
0
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: C₁₇H₂₂ClNO₅
Molecular Weight: 355.81
Synonyms: None
SMILES: O=C(N1CC2=C(C(Cl)=C(OC)C=C2)CC1C(OC)=O)OC(C)(C)C
Tpsa: 65.07
Logp: 3.1834
H Acceptors: 5
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:
C₁₇H₂₂ClNO₅
Molecular Weight:
355.81
Synonyms:
None
SMILES:
O=C(N1CC2=C(C(Cl)=C(OC)C=C2)CC1C(OC)=O)OC(C)(C)C
Tpsa:
65.07
Logp:
3.1834
H Acceptors:
5
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: C₁₃H₁₈BFO₃
Molecular Weight: 252.09
Synonyms: None
SMILES: OC1=C(C)C=C(B2OC(C)(C)C(C)(C)O2)C=C1F
Tpsa: 38.69
Logp: 2.13892
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:
C₁₃H₁₈BFO₃
Molecular Weight:
252.09
Synonyms:
None
SMILES:
OC1=C(C)C=C(B2OC(C)(C)C(C)(C)O2)C=C1F
Tpsa:
38.69
Logp:
2.13892
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: C₉H₁₆F₃NOS
Molecular Weight: 243.29
Synonyms: None
SMILES: CC(C)(C)[S@@](N[C@@H](C1CC1)C(F)(F)F)=O
Tpsa: 29.1
Logp: 2.3791
H Acceptors: 1
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:
C₉H₁₆F₃NOS
Molecular Weight:
243.29
Synonyms:
None
SMILES:
CC(C)(C)[S@@](N[C@@H](C1CC1)C(F)(F)F)=O
Tpsa:
29.1
Logp:
2.3791
H Acceptors:
1
H Donors:
1
Rotatable Bonds:
3
Purity: 98%
MDL No: MFCD03841073
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₁₆O
Molecular Weight: 176.25
Synonyms: neopentyl phenyl ketone
SMILES: CC(C)(C)CC(C1=CC=CC=C1)=O
Tpsa: 17.07
Logp: 3.3055
H Acceptors: 1
H Donors: 0
Rotatable Bonds: 2
Purity:
98%
MDL No:
MFCD03841073
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₁₆O
Molecular Weight:
176.25
Synonyms:
neopentyl phenyl ketone
SMILES:
CC(C)(C)CC(C1=CC=CC=C1)=O
Tpsa:
17.07
Logp:
3.3055
H Acceptors:
1
H Donors:
0
Rotatable Bonds:
2