CAS
93904-60-0 Purity
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93904-60-0 Purity
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3-Chloro-4-hydroxy-5-(isopropyl)benzaldehyde
CAS
93904-64-4
Catalog Number
ACM93904644
Category
Other Products
Molecular Weight
198.646140 [g/mol]
Molecular Formula
C10H11ClO2
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Specification
Synonyms
EINECS 299-803-9, CID3022860, 3-Chloro-4-hydroxy-5-(isopropyl)benzaldehyde, 93904-64-4
IUPAC Name
3-chloro-4-hydroxy-5-propan-2-ylbenzaldehyde
InChI Key
MJPDRZNCPYMJSA-UHFFFAOYSA-N
Boiling Point
269.9ºC at 760mmHg
Flash Point
117ºC
Density
1.229g/cm³
Exact Mass
198.04500
H-Bond Acceptor
2
H-Bond Donor
1
What is the molecular formula of 3-Chloro-4-hydroxy-5-(isopropyl)benzaldehyde?
The molecular formula is C10H11ClO2.
When was 3-Chloro-4-hydroxy-5-(isopropyl)benzaldehyde created and last modified?
It was created on 2005-08-08 and last modified on 2023-12-30.
What is the IUPAC name of 3-Chloro-4-hydroxy-5-(isopropyl)benzaldehyde?
The IUPAC name is 3-chloro-4-hydroxy-5-propan-2-ylbenzaldehyde.
What is the InChIKey of 3-Chloro-4-hydroxy-5-(isopropyl)benzaldehyde?
The InChIKey is MJPDRZNCPYMJSA-UHFFFAOYSA-N.
What is the Canonical SMILES of 3-Chloro-4-hydroxy-5-(isopropyl)benzaldehyde?
The Canonical SMILES is CC(C)C1=C(C(=CC(=C1)C=O)Cl)O.
What is the molecular weight of 3-Chloro-4-hydroxy-5-(isopropyl)benzaldehyde?
The molecular weight is 198.64 g/mol.
How many hydrogen bond donor counts does 3-Chloro-4-hydroxy-5-(isopropyl)benzaldehyde have?
It has 1 hydrogen bond donor count.
What is the exact mass of 3-Chloro-4-hydroxy-5-(isopropyl)benzaldehyde?
The exact mass is 198.0447573 g/mol.
How many rotatable bond counts does 3-Chloro-4-hydroxy-5-(isopropyl)benzaldehyde have?
It has 2 rotatable bond counts.
Is 3-Chloro-4-hydroxy-5-(isopropyl)benzaldehyde a canonicalized compound?
Yes, it is a canonicalized compound.
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