CC(CC=O)O
CAS: 107-89-1
Name: 3-hydroxybutanal
SMILES: CC(CC=O)O

Molecular Processing

Molecular formula
C4H8O2
Molecular weight
88.11
Exact mass
88.0524
XLogP
-0.04
TPSA
37.3
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
6
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.75
Molar refractivity
22.36

Supplementary Information

InChIKey: HSJKGGMUJITCBW-UHFFFAOYSA-N
Synonyme
Aldol3-Hydroxybutanal3-HydroxybutyraldehydeButanal, 3-hydroxy-Oxybutanal107-89-13-ButanolalACETALDOLbeta-HydroxybutyraldehydeOxybutyric aldehydeButyraldehyde, 3-hydroxy-NSC-76108C6G962B53DTXSID2050407RefChem:551525DTXCID8029490203-530-2.beta.-HydroxybutyraldehydeNSC 7610HSDB 2663EINECS 203-530-2UN2839BRN 1735845Aldol-ReaktionAI3-18874UNII-8C6G962B53Aldol, AldrichCPRACETALDOL [HSDB]ALDOL [MI]SCHEMBL9026
Quelle anzeigen →
An 3 Reaktionen beteiligt→

Erweiterte Suche

Teilstruktursuche→Ähnlichkeitssuche→