NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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2-[(benzyloxy)carbonyl](2H4)benzoic acid
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IUPAC Traditional name
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2-[(benzyloxy)carbonyl](2H4)benzoic acid
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Synonyms
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1,2-(Benzene-d4)dicarboxylic Acid 1-(Phenylmethyl) Ester
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1,2-(Benzene-d4)dicarboxylic Acid Mono(phenylmethyl) Ester
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Phthalic Acid-d4 Benzyl Ester
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2-[(Benzyloxy-d4)carbonyl]benzoic Acid
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Benzyl Hydrogen Phthalate-d4
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MBzP-d4
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NSC 402008-d4
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Monobenzyl Phthalate-d4
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CAS Number
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PubChem SID
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PubChem CID
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DATA SOURCES
DATA SOURCES
All Sources Commercial Sources Non-commercial Sources
Data Source
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Data ID
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Price
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TRC
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CALCULATED PROPERTIES
CALCULATED PROPERTIES
JChem
Acid pKa
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3.0835369
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H Acceptors
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3
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H Donor
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1
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LogD (pH = 5.5)
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0.972906
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LogD (pH = 7.4)
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-0.105015464
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Log P
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3.3587787
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Molar Refractivity
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69.9521 cm3
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Polarizability
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26.693525 Å3
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Polar Surface Area
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63.6 Å2
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Rotatable Bonds
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5
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Lipinski's Rule of Five
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true
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PROPERTIES
PROPERTIES
Safety Information
Product Information
Bioassay(PubChem)
DETAILS
DETAILS
TRC
REFERENCES
REFERENCES
From Suppliers
Google Scholar
PubMed
Google Books
- • Mineno, T., et al.: Chem. Pharm. Bull., 57, 1167 (2009)
- • Aylward, L., et al.: Reg. Toxicol. Pharmacol., 55, 259 (2009)
- • Engel, S., et al.: NeuroToxicol., 30, 522 (2009)
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PATENTS
PATENTS
PubChem Patent
Google Patent