Bicyclo[2.2.1]heptane-1-carboxylic Acid - CAS 18720-30-4

Catalog:	BB014405
Product Name:	Bicyclo[2.2.1]heptane-1-carboxylic Acid
CAS:	18720-30-4
Synonyms:	1-bicyclo[2.2.1]heptanecarboxylic acid; bicyclo[2.2.1]heptane-1-carboxylic acid

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Computed Properties

IUPAC Name:	bicyclo[2.2.1]heptane-1-carboxylic acid
Description:	Bicyclo[2.2.1]heptane-1-carboxylic Acid (CAS# 18720-30-4) is a useful research chemical.
Molecular Weight:	140.18
Molecular Formula:	C8H12O2
Canonical SMILES:	C1CC2(CCC1C2)C(=O)O
InChI:	InChI=1S/C8H12O2/c9-7(10)8-3-1-6(5-8)2-4-8/h6H,1-5H2,(H,9,10)
InChI Key:	LKXGYGYFPTZHLC-UHFFFAOYSA-N
Boiling Point:	256.8 °C at 760 mmHg
Density:	1.249 g/cm³
LogP:	1.65130

Publication Number	Title	Priority Date
JP-2020158782-A	Biodegradable copolymer and its manufacturing method and biodegradability improving method	20200630
WO-2021188959-A1	Prodrugs of 4'-c-substituted-2-halo-2'-deoxyadenosine nucleosides and methods of making and using the same	20200320
WO-2021188528-A1	Thermoplastic elastomer compositions their preparation and use in fiber-reinforced spoolable pipes	20200318
JP-2021134216-A	Fluorene compounds and resins using them	20200221
JP-2021134355-A	Thermoplastic resin having a binaphthyl skeleton and its manufacturing method and application	20200221

PMID	Publication Date	Title	Journal
11597402	20011105	Studies on 3-deoxy-D-manno-octulosonic acid 8-phosphate synthase using chorismate mutase inhibitors	Bioorganic & medicinal chemistry letters

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GHS Hazard Statement:	H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	166
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	140.083729621
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	140.083729621
Rotatable Bond Count:	1
Topological Polar Surface Area:	37.3 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.5