CS-1016751
Dimethyl 2-(3-chloro-5-cyanophenyl)malonate
Manufacturer: ChemScene
CAS Number: 3030347-34-0
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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
C₁₂H₁₀ClNO₄
Molecular Weight
267.67
Synonyms
None
SMILES
O=C(OC)C(C1=CC(C#N)=CC(Cl)=C1)C(OC)=O
Tpsa
76.39
Logp
1.64128
H Acceptors
5
H Donors
0
Rotatable Bonds
3
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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: C₁₂H₁₀ClNO₄
Molecular Weight: 267.67
Synonyms: None
SMILES: O=C(OC)C(C1=CC(C#N)=CC(Cl)=C1)C(OC)=O
Tpsa: 76.39
Logp: 1.64128
H Acceptors: 5
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:
C₁₂H₁₀ClNO₄
Molecular Weight:
267.67
Synonyms:
None
SMILES:
O=C(OC)C(C1=CC(C#N)=CC(Cl)=C1)C(OC)=O
Tpsa:
76.39
Logp:
1.64128
H Acceptors:
5
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: C₁₆H₁₈ClNO₂
Molecular Weight: 291.77
Synonyms: None
SMILES: O=C(NC1=CC(C#CC2CC2)=CC=C1Cl)OC(C)(C)C
Tpsa: 38.33
Logp: 4.4485
H Acceptors: 2
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:
C₁₆H₁₈ClNO₂
Molecular Weight:
291.77
Synonyms:
None
SMILES:
O=C(NC1=CC(C#CC2CC2)=CC=C1Cl)OC(C)(C)C
Tpsa:
38.33
Logp:
4.4485
H Acceptors:
2
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: C₉H₇BrN₂O
Molecular Weight: 239.07
Synonyms: None
SMILES: N#CC1=NC=C(Br)C=C1OC2CC2
Tpsa: 45.91
Logp: 2.25698
H Acceptors: 3
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:
C₉H₇BrN₂O
Molecular Weight:
239.07
Synonyms:
None
SMILES:
N#CC1=NC=C(Br)C=C1OC2CC2
Tpsa:
45.91
Logp:
2.25698
H Acceptors:
3
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: C₉H₈BrNO₂
Molecular Weight: 242.07
Synonyms: None
SMILES: O=CC1=NC=C(Br)C=C1OC2CC2
Tpsa: 39.19
Logp: 2.1978
H Acceptors: 3
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:
C₉H₈BrNO₂
Molecular Weight:
242.07
Synonyms:
None
SMILES:
O=CC1=NC=C(Br)C=C1OC2CC2
Tpsa:
39.19
Logp:
2.1978
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
3