CAS
90417-95-1 Purity
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90417-95-1 Purity
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3,5-Dichlorocinnamic acid
CAS
90418-21-6
Catalog Number
ACM90418216
Category
Other Products
Molecular Weight
217.048740 [g/mol]
Molecular Formula
C9H6Cl2O2
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Specification
Synonyms
3-(3,5-dichlorophenyl)acrylic acid, SBB068809, 90418-21-6, AC1O5WO1, AC1Q71FX, (E)-3-(3,5-dichlorophenyl)prop-2-enoic Acid, SureCN1251510, MolPort-001-766-963, 3-(3,5-Dichlorophenyl)-acrylic acid, AKOS000136540, 3-(3,5-dichlorophenyl)prop-2-enoic acid, FT-0653725, EN300-24214, (E)-3-(3,5-dichlorophenyl)-2-propenoic acid, D80186, (2E)-3-(3,5-dichlorophenyl)prop-2-enoic acid, A843540, AN-584/43408166, S01-0275, (E)-3-[3,5-bis(chloranyl)phenyl]prop-2-enoic acid
IUPAC Name
(E)-3-(3,5-dichlorophenyl)prop-2-enoic acid
Canonical SMILES
C1=C(C=C(C=C1Cl)Cl)C=CC(=O)O
InChI Key
HJKSYRZNDJQTJQ-OWOJBTEDSA-N
Boiling Point
364.8ºC at 760mmHg
Flash Point
174.4ºC
Density
1.457g/cm³
Exact Mass
215.97400
H-Bond Acceptor
2
H-Bond Donor
1
What is the molecular formula of 3,5-Dichlorocinnamic acid?
The molecular formula of 3,5-Dichlorocinnamic acid is C9H6Cl2O2.
When was 3,5-Dichlorocinnamic acid created in PubChem?
3,5-Dichlorocinnamic acid was created in PubChem on April 28, 2006.
What is the IUPAC name of 3,5-Dichlorocinnamic acid?
The IUPAC name of 3,5-Dichlorocinnamic acid is (E)-3-(3,5-dichlorophenyl)prop-2-enoic acid.
What is the InChI key of 3,5-Dichlorocinnamic acid?
The InChI key of 3,5-Dichlorocinnamic acid is HJKSYRZNDJQTJQ-OWOJBTEDSA-N.
What is the canonical SMILES of 3,5-Dichlorocinnamic acid?
The canonical SMILES of 3,5-Dichlorocinnamic acid is C1=C(C=C(C=C1Cl)Cl)C=CC(=O)O.
What is the molecular weight of 3,5-Dichlorocinnamic acid?
The molecular weight of 3,5-Dichlorocinnamic acid is 217.05 g/mol.
What is the CAS number of 3,5-Dichlorocinnamic acid?
The CAS number of 3,5-Dichlorocinnamic acid is 90418-21-6.
What is the XLogP3-AA value of 3,5-Dichlorocinnamic acid?
The XLogP3-AA value of 3,5-Dichlorocinnamic acid is 3.1.
How many hydrogen bond donor counts does 3,5-Dichlorocinnamic acid have?
3,5-Dichlorocinnamic acid has 1 hydrogen bond donor count.
How many rotatable bond counts does 3,5-Dichlorocinnamic acid have?
3,5-Dichlorocinnamic acid has 2 rotatable bond counts.
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