CS-1068692
3-(Aminomethyl)-1-methyl-2-oxabicyclo[2.1.1]hexane-4-carboxylic acid
Manufacturer: ChemScene
CAS Number: 2694744-44-8
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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
C₈H₁₃NO₃
Molecular Weight
171.19
Synonyms
None
SMILES
O=C(O)C12CC(OC1CN)(C)C2
Tpsa
72.55
Logp
-0.0326
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: C₈H₁₃NO₃
Molecular Weight: 171.19
Synonyms: None
SMILES: O=C(O)C12CC(OC1CN)(C)C2
Tpsa: 72.55
Logp: -0.0326
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:
C₈H₁₃NO₃
Molecular Weight:
171.19
Synonyms:
None
SMILES:
O=C(O)C12CC(OC1CN)(C)C2
Tpsa:
72.55
Logp:
-0.0326
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: C₇H₄IN₃O₂
Molecular Weight: 289.03
Synonyms: None
SMILES: O=C(O)C1=CC=NC2=C(I)C=NN21
Tpsa: 67.49
Logp: 1.0321
H Acceptors: 4
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:
C₇H₄IN₃O₂
Molecular Weight:
289.03
Synonyms:
None
SMILES:
O=C(O)C1=CC=NC2=C(I)C=NN21
Tpsa:
67.49
Logp:
1.0321
H Acceptors:
4
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: C₁₂H₁₄N₂OS
Molecular Weight: 234.32
Synonyms: None
SMILES: O=C(C=1SC2=NC(=CC(=C2C1NC)C)C)C
Tpsa: 41.99
Logp: 3.15744
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:
C₁₂H₁₄N₂OS
Molecular Weight:
234.32
Synonyms:
None
SMILES:
O=C(C=1SC2=NC(=CC(=C2C1NC)C)C)C
Tpsa:
41.99
Logp:
3.15744
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: C₇H₁₃N₃
Molecular Weight: 139.20
Synonyms: None
SMILES: N1=CC(NC)=C(N1CC)C
Tpsa: 29.85
Logp: 1.25312
H Acceptors: 3
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:
C₇H₁₃N₃
Molecular Weight:
139.20
Synonyms:
None
SMILES:
N1=CC(NC)=C(N1CC)C
Tpsa:
29.85
Logp:
1.25312
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
2