CS-0771097
Methyl 3-Nitro-4-Thiocyanatobenzoate
Manufacturer: ChemScene
CAS Number: 6083-80-3
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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
C₉H₆N₂O₄S
Molecular Weight
238.22
Synonyms
None
SMILES
COC(=O)C1=CC=C(SC#N)C(=C1)[N+]([O-])=O
Tpsa
93.23
Logp
1.95458
H Acceptors
6
H Donors
0
Rotatable Bonds
3
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: C₉H₆N₂O₄S
Molecular Weight: 238.22
Synonyms: None
SMILES: COC(=O)C1=CC=C(SC#N)C(=C1)[N+]([O-])=O
Tpsa: 93.23
Logp: 1.95458
H Acceptors: 6
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:
C₉H₆N₂O₄S
Molecular Weight:
238.22
Synonyms:
None
SMILES:
COC(=O)C1=CC=C(SC#N)C(=C1)[N+]([O-])=O
Tpsa:
93.23
Logp:
1.95458
H Acceptors:
6
H Donors:
0
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: C₁₀H₈BrClF₃NO₂
Molecular Weight: 346.53
Synonyms: None
SMILES: CCOC(=O)C(Br)C1=NC=C(C=C1Cl)C(F)(F)F
Tpsa: 39.19
Logp: 3.7529
H Acceptors: 3
H Donors: 0
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:
C₁₀H₈BrClF₃NO₂
Molecular Weight:
346.53
Synonyms:
None
SMILES:
CCOC(=O)C(Br)C1=NC=C(C=C1Cl)C(F)(F)F
Tpsa:
39.19
Logp:
3.7529
H Acceptors:
3
H Donors:
0
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: C₁₄H₁₂ClNO₂
Molecular Weight: 261.70
Synonyms: None
SMILES: CCOC(=O)C1=CC=C(N=C1Cl)C1=CC=CC=C1
Tpsa: 39.19
Logp: 3.5787
H Acceptors: 3
H Donors: 0
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:
C₁₄H₁₂ClNO₂
Molecular Weight:
261.70
Synonyms:
None
SMILES:
CCOC(=O)C1=CC=C(N=C1Cl)C1=CC=CC=C1
Tpsa:
39.19
Logp:
3.5787
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: C₁₅H₁₄ClNO₃
Molecular Weight: 291.73
Synonyms: None
SMILES: CCOC(=O)C1=CC=C(N=C1Cl)C1=CC=C(OC)C=C1
Tpsa: 48.42
Logp: 3.5873
H Acceptors: 4
H Donors: 0
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₅H₁₄ClNO₃
Molecular Weight:
291.73
Synonyms:
None
SMILES:
CCOC(=O)C1=CC=C(N=C1Cl)C1=CC=C(OC)C=C1
Tpsa:
48.42
Logp:
3.5873
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
4