(1S)-(+)-3-CARENE

CAS No.
13466-78-9 ;498-15-7
CCD No.
CCD00043963
Formula
C10 H16
MolWeight
136.236

Basic Information

Product Name: (1S)-(+)-3-CARENE
CAS: 13466-78-9 ;498-15-7
English Synonyms: (1S)-3,7,7-TRIMETHYLBICYCLO[4.1.0]HEPT-3-ENE ; (+)-3-CARENE ; 3-CARENE ; (1S)-(+)-3-CARENE
MDL Number.: MFCD00066417
H bond acceptor: 0
H bond donor: 0
Smile: CC1=CC[C@@H]2[C@H](C1)C2(C)C
InChi: InChI=1S/C10H16/c1-7-4-5-8-9(6-7)10(8,2)3/h4,8-9H,5-6H2,1-3H3/t8-,9+/m1/s1
InChiKey: InChIKey=BQOFWKZOCNGFEC-BDAKNGLRSA-N

Property

Boiling Point: 170-172 DEG C(LIT)
Density: 0.865g/mLat25°C(lit.)
Physical Property: FLASHPOINT: 131 DEG F
FLASHPOINT: 55 DEG C
REFRACTIVE INDEX: N20/D 1.472(LIT)
Comments: APPLICATION: CHIRAL BUILDING BLOCK FOR THE PREPARATION OF BICYCLO[3.2.0]HEPTENES THAT ARE USEFUL INTERMEDIATES IN THE SYNTHESIS OF (+)-LINEATIN AND BOTH ENANTIOMERS OF CAPNELLENE. HAS BEEN CONVERTED TO ITS CORRESPONDING ALLENYL ALLYLIC ETHER FOR STUDIES OF ITS THERMAL ISOMERIZATION CHEMISTRY. PRECURSOR TO DI(4-ISOCARANYL)BORANE, AN ASYMMETRIC HYDROBORATION REAGENT FOR OLEFINS
OPTICAL ACTIVITY: [ALPHA]20/D +17 DEG, NEAT
RIDADR: UN 2319 3/PG 3
UNSPSC: 12352100
WGK: 3

Safety information

Symbol: GHS02 GHS02 GHS07 GHS07 GHS09 GHS09
Signal word: Warning
Hazard statements: H226-H317-H410
Precautionary statements: P273-P280-P501
hazard symbol: Xi,N
Risk Code: R:10-43-50/53
Safe Code: S:36/37-60-61
WGK Germany: 3

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