1-Chloro-3,4-dihydronaphthalene-2-carboxaldehyde

HCID 76752CAS 3262-03-1
Substructure searchFind similar structures

Basic information

Standard SMILES
O=CC1=C(Cl)c2ccccc2CC1
InChIKey
GBRFPPIJEHQBGK-UHFFFAOYSA-N
Molecular formula
C11H9ClO
Average molar mass
192.64 g/mol
Monoisotopic mass
192.0341926

Names & identifiers

Preferred name
1-Chloro-3,4-dihydronaphthalene-2-carboxaldehyde
IUPAC
1-chloro-3,4-dihydronaphthalene-2-carbaldehyde
English name
1-Chloro-3,4-dihydro-2-naphthalenecarbaldehyde
Molecular formula
C11H9ClO
Molecular weight
192.64

Names & synonyms

1-Chloro-3,4-dihydronaphthalene-2-carboxaldehyde1-C-DNCA cpdRefChem:9075461-Chloro-3,4-dihydronaphthalene-2-carbaldehyde3262-03-11-CHLORO-3,4-DIHYDRO-2-NAPHTHALENECARBALDEHYDEC11H9ClOMFCD022577351-Chloro-3,4-dihydro-naphthalene-2-carbaldehydeNSC 1418132QE2WH6M6JNSC-141813
Show more names
1-chloro-2-formyl-3,4-dihydronaphthalene1-Chloro-3,4-dihydronaphthalene-2-aldehyde1-Chloro-3,4-dihydro-2-naphthalenecarbaldehhyde
2-Naphthaldehyde, 1-chloro-3,4-dihydro-4-chloro-3-formyl-1,2-dihydro-naphthaleneNSC141813UNII-2QE2WH6M6J2-Naphthalenecarboxaldehyde, 1-chloro-3,4-dihydro-SCHEMBL2063760CHEMBL1797251SCHEMBL29952458

Database identifiers

CAS
3262-03-1
PubChem CID
76752
DTXSID
DTXSID50186308
ChEMBL
CHEMBL1797251
UNII
2QE2WH6M6J
EC Number
221-866-8
Nikkaji
J262.362E

Properties

Computed structural properties

XLogP
2.5
Topological polar surface area
17.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
1
Heavy atoms
13

Physicochemical properties

Melting point
36 · 36-39°C
Boiling point
145 · 145-153 °C(Press: 5 Torr)
Density
1.24 · 1.24±0.1 g/cm3(Predicted)
FDA UNII
2 QE2WH6M6J · 2QE2WH6M6J
Symbol(GHS)
7 · GHS07
Signal word
Warning

Safety & regulation

Safety data

hs_code
2913000090
risk_code
22
Signal word
Warning
Symbol(GHS)
GHS07
hazard_code
Xn
hazard_class
IRRITANT

Chemistry & industry

Applications

Uses1-Chloro-3,4-dihydronaphthalene-2-carbaldehyde

Upstream & downstream products

Suppliers23 total

上海衡新化工科技有限公司13917104483; 13917104483 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
河南赢创生物科技有限公司16650615803 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]

Related reactions

6 records
New reaction record

Linked notes

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