4H-1,3-Benzoxazin-4-one, 6-chloro-2-(2-chloropropyl)-2,3-dihydro-3-hydroxy-

HCID 112684
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Basic information

CAS
63482-60-0
Standard SMILES
CC(Cl)CC1Oc2ccc(Cl)cc2C(=O)N1O
InChIKey
PURUODHGBYOTFL-UHFFFAOYSA-N
Molecular formula
C11H11Cl2NO3
Average molar mass
276.11 g/mol
Monoisotopic mass
275.01159857

Names & identifiers

Preferred name
4H-1,3-Benzoxazin-4-one, 6-chloro-2-(2-chloropropyl)-2,3-dihydro-3-hydroxy-
IUPAC
6-chloro-2-(2-chloropropyl)-3-hydroxy-2H-1,3-benzoxazin-4-one
English name
6-chloro-2-(2-chloropropyl)-2,3-dihydro-3-hydroxy-4H-1,3-benzoxazin-4-one
Molecular formula
C11H11Cl2NO3
Molecular weight
276.12

Names & synonyms

6-Chloro-2-(2-chloropropyl)-2,3-dihydro-3-hydroxy-4H-1,3-benzoxazin-4-oneEINECS 264-266-14H-1,3-Benzoxazin-4-one, 6-chloro-2-(2-chloropropyl)-2,3-dihydro-3-hydroxy-DTXSID30886612RefChem:100662DTXCID201025936264-266-163482-60-06-chloro-2-(2-chloropropyl)-3-hydroxy-2H-1,3-benzoxazin-4-oneSCHEMBL11455858DB-306975NS00054840
Show more names
6-CHLORO-2-(2-CHLOROPROPYL)-3-HYDROXY-2H-1,3-BENZOXAZIN-4-ONE(WXG02948)6-Chloro-2-(2-chloropropyl)-3,4-dihydro-3-hydroxy-2H-1,3-benzoxazin-4-one
6-chloro-2-(2-chloropropyl)-2,3-dihydro-3-hydroxy-4H-1, 3-benzoxazin-4-one6-chloro-2-(2-chloropropyl)-3-hydroxy-2,3-dihydro-4H-1,3-benzoxazin-4-one

Database identifiers

CAS
63482-60-0
PubChem CID
112684
DTXSID
DTXSID30886612
EC Number
264-266-1
Nikkaji
J349.240K

Properties

Computed structural properties

XLogP
2.8
Topological polar surface area
49.8 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
2
Heavy atoms
17

Physicochemical properties

Melting point
113 · 113-115 °C(Solv: ligroine (8032-32-4))
Boiling point
450.9 · 450.9±55.0 °C(Predicted)
Density
1.455 · 1.455±0.06 g/cm3(Predicted)
pka
8.09 · 8.09±0.40(Predicted)
EPA Substance Registry System
4 H-1,3-Benzoxazin-4-one, · 4H-1,3-Benzoxazin-4-one, 6-chloro-2-(2-chloropropyl)-2,3-dihydro-3-hydroxy- (63482-60-0)
TSCA
TSCA listed

Safety & regulation

Safety data

tsca
TSCA listed

Chemistry & industry

Uses & manufacturing

General Manufacturing Information4H-1,3-Benzoxazin-4-one, 6-chloro-2-(2-chloropropyl)-2,3-dihydro-3-hydroxy-: INACTIVE

Suppliers2 total

苏州美石生物科技有限公司1173954148q · [email protected]
药明览博(武汉)化学科技有限公司022-59987777 13552403979 · [email protected]

Related reactions

2 records
New reaction record

Compound notes

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