CS-0535167
4-Cyano-2-(hydroxymethyl)benzoic acid
Manufacturer: ChemScene
CAS Number: 1378843-02-7
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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
C₉H₇NO₃
Molecular Weight
177.16
Synonyms
None
SMILES
O=C(O)C1=CC=C(C#N)C=C1CO
Tpsa
81.32
Logp
0.74878
H Acceptors
3
H Donors
2
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: C₉H₇NO₃
Molecular Weight: 177.16
Synonyms: None
SMILES: O=C(O)C1=CC=C(C#N)C=C1CO
Tpsa: 81.32
Logp: 0.74878
H Acceptors: 3
H Donors: 2
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:
C₉H₇NO₃
Molecular Weight:
177.16
Synonyms:
None
SMILES:
O=C(O)C1=CC=C(C#N)C=C1CO
Tpsa:
81.32
Logp:
0.74878
H Acceptors:
3
H Donors:
2
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: Benzoic acid, 4-cyano-2-(hydroxymethyl)-, methyl ester
SMILES: O=C(OC)C1=CC=C(C#N)C=C1CO
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:
Benzoic acid, 4-cyano-2-(hydroxymethyl)-, methyl ester
SMILES:
O=C(OC)C1=CC=C(C#N)C=C1CO
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: C₈H₁₈O₄S
Molecular Weight: 210.29
Synonyms: Sulfuric acid, bis(2-Methylpropyl) ester
SMILES: CC(C)COS(=O)(=O)OCC(C)C
Tpsa: 52.6
Logp: 1.5764
H Acceptors: 4
H Donors: 0
Rotatable Bonds: 6
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₁₈O₄S
Molecular Weight:
210.29
Synonyms:
Sulfuric acid, bis(2-Methylpropyl) ester
SMILES:
CC(C)COS(=O)(=O)OCC(C)C
Tpsa:
52.6
Logp:
1.5764
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
6
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₃H₈N₂O
Molecular Weight: 88.11
Synonyms: N-methylacetohydrazide
SMILES: CC(N(C)N)=O
Tpsa: 46.33
Logp: -0.6616
H Acceptors: 2
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:
C₃H₈N₂O
Molecular Weight:
88.11
Synonyms:
N-methylacetohydrazide
SMILES:
CC(N(C)N)=O
Tpsa:
46.33
Logp:
-0.6616
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
0