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3-(4-Hydroxymethyl-phenyl)-propan-1-OL

HCID 11240697
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Basic information

CAS
38628-53-4
Standard SMILES
OCCCc1ccc(CO)cc1
InChIKey
HOLRRRVDKVZVNG-UHFFFAOYSA-N
Molecular formula
C10H14O2
Average molar mass
166.22 g/mol
Monoisotopic mass
166.09937969

Names & identifiers

Preferred name
3-(4-Hydroxymethyl-phenyl)-propan-1-OL
IUPAC
3-[4-(hydroxymethyl)phenyl]propan-1-ol
English name
3-(4-Hydroxymethyl-phenyl)-propan-1-ol
Molecular formula
C10H14O2
Molecular weight
166.22

Names & synonyms

38628-53-43-(4-HYDROXYMETHYL-PHENYL)-PROPAN-1-OLDTXSID90459740RefChem:274647DTXCID504105593-[4-(hydroxymethyl)phenyl]propan-1-ol3-(4-(Hydroxymethyl)phenyl)propan-1-olSCHEMBL2329516HOLRRRVDKVZVNG-UHFFFAOYSA-NAKOS006288349DB-3307573-(4-HYDROXYMETHYLPHENYL)-1-PROPANOL
Show more names
4-(Hydroxymethyl)benzenepropanol

Database identifiers

CAS
38628-53-4
PubChem CID
11240697
DTXSID
DTXSID90459740
Nikkaji
J3.600.319G

Properties

Computed structural properties

XLogP
1
Topological polar surface area
40.5 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
2
Rotatable bonds
4
Heavy atoms
12
Formal charge
0
Complexity
106

Physicochemical properties

HS Code
2906290090 · 2906290090

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

hs_code
2906290090

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Related reactions

4 records
New reaction record
HRID 293236 reaction equation
HRID 293236As reactantTraining data from https://doi.org/10.1039/C8SC04228D (8/10)
HRID 955647 reaction equation
HRID 955647As productValidation data from https://doi.org/10.1039/C8SC04228D
HRID 2261436 reaction equation
HRID 2261436As productuspto-grants-2010_12
HRID 2261437 reaction equation
HRID 2261437As reactantuspto-grants-2010_12

Compound notes

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