CAS
494211-79-9 Purity
96%
494211-79-9 Purity
96%
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1-Adamantaneacetic acid
CAS
4942-47-6
Catalog Number
ACM4942476
Category
Other Products
Molecular Weight
194.27
Molecular Formula
C12H18O2
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Specification
Synonyms
1-Adamantaneacetic acid, 1-Adamantylacetic acid, Ambap701, Maybridge1_002200, Oprea1_744522, 127272_ALDRICH, ALBB-000785, EINECS 225-585-1, NSC310162, ST5202965, Tricyclo(3.3.1.13,7)dec-1-ylacetic acid, Tricyclo[3.3.1.1(3,7)-]decane-1-acetic acid, Tricyclo[3.3.1.13,7]decane-1-acetic acid, 4942-47-6
IUPAC Name
2-(1-adamantyl)acetic acid
Canonical SMILES
C1C2CC3CC1CC(C2)(C3)CC(=O)O
InChI Key
AOTQGWFNFTVXNQ-UHFFFAOYSA-N
Boiling Point
319.2ºC at 760 mmHg
Melting Point
136-138ºC
Flash Point
163ºC
Density
1.167 g/cm³
Appearance
white to off-white crystalline powder or crystals
EC Number
225-585-1
Exact Mass
194.13100
Hazard Statements
Xi: Irritant;Xn: Harmful;F: Flammable;
H-Bond Acceptor
2
H-Bond Donor
1
Safety Description
S22-S24/25
WGK Germany
3
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