3-carboxymethyl adamantane-1-carboxylic acid

Modify Date: 2026-07-01 16:35:45

3-carboxymethyl adamantane-1-carboxylic acid Structure
3-carboxymethyl adamantane-1-carboxylic acid structure
Common Name 3-carboxymethyl adamantane-1-carboxylic acid
CAS Number 56531-58-9 Molecular Weight 238.280
Density 1.4±0.1 g/cm3 Boiling Point 438.7±18.0 °C at 760 mmHg
Molecular Formula C13H18O4 Melting Point 91-95ºC
MSDS Chinese USA Flash Point 233.2±17.7 °C
Symbol GHS07
GHS07
Signal Word Warning

 Names

Name 3-(Carboxymethyl)adamantane-1-carboxylic acid
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.4±0.1 g/cm3
Boiling Point 438.7±18.0 °C at 760 mmHg
Melting Point 91-95ºC
Molecular Formula C13H18O4
Molecular Weight 238.280
Flash Point 233.2±17.7 °C
Exact Mass 238.120514
PSA 74.60000
LogP 1.67
Vapour Pressure 0.0±2.3 mmHg at 25°C
Index of Refraction 1.596
InChIKey YQXJBYAQGPMUEP-UHFFFAOYSA-N
SMILES O=C(O)CC12CC3CC(C1)CC(C(=O)O)(C3)C2

 Safety Information

Symbol GHS07
GHS07
Signal Word Warning
Hazard Statements H302
Personal Protective Equipment dust mask type N95 (US);Eyeshields;Gloves
Hazard Codes Xn
Risk Phrases 22-52/53
Safety Phrases 61
RIDADR NONH for all modes of transport
HS Code 2917209090

 Customs

HS Code 2917209090
Summary 2917209090 other cyclanic, cyclenic or cyclotherpenic polycarboxylic acids, their anhydrides, halides, peroxides, peroxyacids and their derivatives。supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward)。VAT:17.0%。tax rebate rate:9.0%。MFN tariff:6.5%。general tariff:30.0%

 Bioassay

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Name: Discovery of Small Molecules to Inhibit Human Cytomegalovirus Nuclear Egress
Source: ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
Target: HCMV UL50
External Id: HMS1262
Name: qHTS assay for inhibitors of human lactate dehydrogenase
Source: NCGC
Target: N/A
External Id: LDHA
Name: Primary qHTS Assay for Foot and Mouth Disease Virus Antivirals against NCGC Sytravon ...
Source: NCGC
External Id: stopgo-p2-SytraCBC-dual-FF
Name: A screen for compounds that inhibit the activity of LtaS in Staphylococcus aureus
Source: ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
External Id: HMS979
Name: Primary qHTS Assay for Foot and Mouth Disease Virus Antivirals against NCGC Sytravon ...
Source: NCGC
External Id: stopgo-p2-SytraCBC-dual-Ren
Name: A screen for compounds that inhibit viral RNA polymerase binding and polymerization a...
Source: ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
Target: Chain A, Poliovirus Polymerase With Gtp
External Id: HMS750
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 Synonyms

3-Carboxyadamantane-1-acetic acid
3-carboxy-1-adamantylacetic acid
(1s,3r,5R,7S)-3-(Carboxymethyl)-1-adamantanecarboxylic acid
3-CARBOXYMETHYLADAMANTANE-1-CARBOXYLIC ACID
3-carboxymethyl adamantane-1-carboxylic acid
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