CS-0888590
Methyl 3-cyano-4-(hydroxymethyl)benzoate
Manufacturer: ChemScene
CAS Number: 1823878-82-5
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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
C₁₀H₉NO₃
Molecular Weight
191.18
Synonyms
None
SMILES
O=C(OC)C1=CC=C(CO)C(C#N)=C1
Tpsa
70.32
Logp
0.83718
H Acceptors
4
H Donors
1
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: C₁₀H₉NO₃
Molecular Weight: 191.18
Synonyms: None
SMILES: O=C(OC)C1=CC=C(CO)C(C#N)=C1
Tpsa: 70.32
Logp: 0.83718
H Acceptors: 4
H Donors: 1
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:
C₁₀H₉NO₃
Molecular Weight:
191.18
Synonyms:
None
SMILES:
O=C(OC)C1=CC=C(CO)C(C#N)=C1
Tpsa:
70.32
Logp:
0.83718
H Acceptors:
4
H Donors:
1
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: C₈H₇BrFN
Molecular Weight: 216.05
Synonyms: None
SMILES: FC1=CC(Br)=CN=C1C2CC2
Tpsa: 12.89
Logp: 2.8606
H Acceptors: 1
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:
C₈H₇BrFN
Molecular Weight:
216.05
Synonyms:
None
SMILES:
FC1=CC(Br)=CN=C1C2CC2
Tpsa:
12.89
Logp:
2.8606
H Acceptors:
1
H Donors:
0
Rotatable Bonds:
1
Purity: 95%
MDL No: MFCD18390995
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₇BrF₂O
Molecular Weight: 237.04
Synonyms: None
SMILES: CC1=CC(OC(F)F)=CC=C1Br
Tpsa: 9.23
Logp: 3.35892
H Acceptors: 1
H Donors: 0
Rotatable Bonds: 2
Purity:
95%
MDL No:
MFCD18390995
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₇BrF₂O
Molecular Weight:
237.04
Synonyms:
None
SMILES:
CC1=CC(OC(F)F)=CC=C1Br
Tpsa:
9.23
Logp:
3.35892
H Acceptors:
1
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: C₁₃H₁₆N₂O₃
Molecular Weight: 248.28
Synonyms: None
SMILES: O=C(N(CC1=C2C=C(N)C=C1)C2=O)OC(C)(C)C
Tpsa: 72.63
Logp: 2.1597
H Acceptors: 4
H Donors: 1
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:
C₁₃H₁₆N₂O₃
Molecular Weight:
248.28
Synonyms:
None
SMILES:
O=C(N(CC1=C2C=C(N)C=C1)C2=O)OC(C)(C)C
Tpsa:
72.63
Logp:
2.1597
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
0